data_5nr6_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 5nr6 _Structure_validation_residue.Date_analyzed 2017-09-15 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 ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.547 0.857 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.9 m -93.17 -73.13 0.57 Allowed 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.186 -0.946 . . . . 0.0 113.061 -168.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -162.61 -45.68 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.939 0.496 . . . . 0.0 111.432 -174.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.77 -33.89 76.61 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.641 0.777 . . . . 0.0 110.577 174.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.0 -38.75 83.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.602 1.161 . . . . 0.0 111.375 -176.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -64.89 -37.76 88.7 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 172.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -66.12 -2.42 4.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 171.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.6 mt -105.21 -53.29 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.104 1.362 . . . . 0.0 110.432 165.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.3 t -69.96 -64.06 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.059 0.845 . . . . 0.0 111.817 -173.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.62 -30.74 68.55 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 111.704 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -55.87 -36.93 68.14 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 166.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.34 -37.9 60.45 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.241 1.016 . . . . 0.0 112.311 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mm -61.5 -30.96 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 121.044 -1.035 . . . . 0.0 110.501 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 t -72.81 -17.0 61.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.91 1.284 . . . . 0.0 114.286 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -101.38 -42.66 6.2 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.601 -1.312 . . . . 0.0 112.745 -169.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.6 m -129.04 -13.31 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -169.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.88 -78.26 0.38 Allowed Glycine 0 N--CA 1.47 0.915 0 C-N-CA 125.187 1.375 . . . . 0.0 112.198 165.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tp -160.6 -45.87 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.592 1.157 . . . . 0.0 112.287 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -109.74 -8.28 14.95 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.801 1.64 . . . . 0.0 114.28 -167.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -88.72 -14.29 37.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.873 0.869 . . . . 0.0 112.852 -175.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -66.52 166.67 12.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.724 1.21 . . . . 0.0 112.082 164.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -119.09 165.16 14.5 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 122.427 1.108 . . . . 0.0 111.716 170.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.89 -26.78 59.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.551 1.14 . . . . 0.0 112.679 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -65.38 -46.06 81.56 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 112.123 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -67.37 -27.92 67.52 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.578 -1.326 . . . . 0.0 113.088 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.37 -56.92 6.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.201 1.0 . . . . 0.0 111.695 167.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.2 p -60.3 -26.68 66.7 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.565 1.146 . . . . 0.0 113.703 -177.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -70.37 -27.41 64.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.12 1.368 . . . . 0.0 113.74 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -114.08 -31.57 6.31 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.753 1.221 . . . . 0.0 113.454 -174.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.3 mt -84.69 -19.03 33.45 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.413 1.485 . . . . 0.0 112.723 173.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.53 22.38 12.09 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 126.166 1.786 . . . . 0.0 114.164 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.5 pt -73.64 164.84 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.963 1.705 . . . . 0.0 110.538 163.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.3 t -76.34 156.8 33.01 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.512 -0.742 . . . . 0.0 110.946 166.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.09 -38.37 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.01 0.924 . . . . 0.0 111.487 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -70.08 -31.39 68.96 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -67.93 -36.67 80.55 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.076 168.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.05 -47.33 71.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.445 1.02 . . . . 0.0 111.196 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.9 mtpt -55.3 -43.38 74.77 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.536 1.534 . . . . 0.0 112.631 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -82.5 -38.23 24.14 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.8 -39.3 73.88 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.866 -1.146 . . . . 0.0 112.59 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.9 mt -48.94 -65.98 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.338 1.455 . . . . 0.0 110.453 173.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -64.91 -27.14 68.65 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 . . . . . 0 CA--C 1.54 0.584 0 CA-C-N 119.463 1.029 . . . . 0.0 112.841 -177.106 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.4 4.93 0.38 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.688 1.995 . . . . 0.0 115.575 -172.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.57 -10.84 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 120.145 -1.597 . . . . 0.0 113.647 -173.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -68.03 9.25 0.32 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.12 2.168 . . . . 0.0 115.352 -176.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -92.01 -6.0 51.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 128.611 2.764 . . . . 0.0 114.234 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.2 m -141.47 -45.66 0.37 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.138 1.775 . . . . 0.0 110.489 -170.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.0 pt -64.09 168.12 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 123.689 0.796 . . . . 0.0 111.193 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? 69.06 -14.94 0.28 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 126.694 1.998 . . . . 0.0 116.241 -177.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.39 19.72 2.39 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 120.414 1.461 . . . . 0.0 114.777 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -142.94 -24.58 0.62 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.169 1.544 . . . . 0.0 115.169 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 . . . . . 0 CA--C 1.542 0.673 0 O-C-N 121.228 -0.92 . . . . 0.0 111.728 -178.654 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.1 m -95.5 -69.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.284 . . . . 0.0 112.729 -168.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -161.72 -43.42 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -172.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -73.4 -26.05 60.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.139 0.576 . . . . 0.0 110.59 175.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 -69.73 -41.57 75.13 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.357 1.463 . . . . 0.0 110.391 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -62.47 -36.27 81.94 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.807 0.843 . . . . 0.0 112.834 168.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -65.37 -3.97 4.91 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.6 mt -109.29 -20.59 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.834 1.654 . . . . 0.0 112.393 173.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.6 t -122.89 -53.88 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 CA-C-N 119.463 1.028 . . . . 0.0 113.634 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.83 -33.34 73.97 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.616 1.098 . . . . 0.0 110.948 171.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.76 -43.88 97.42 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.874 0.87 . . . . 0.0 113.055 167.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -36.24 78.16 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.624 1.17 . . . . 0.0 112.131 -178.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.95 -24.62 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 124.883 1.273 . . . . 0.0 111.649 171.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -80.56 -16.86 53.16 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.025 1.121 . . . . 0.0 114.025 171.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -94.82 -50.65 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.668 -1.27 . . . . 0.0 112.009 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 m -123.53 -13.84 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -167.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 124.2 -75.42 0.39 Allowed Glycine 0 N--CA 1.469 0.888 0 C-N-CA 125.328 1.442 . . . . 0.0 112.913 163.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.5 tp -166.78 -40.74 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.437 1.495 . . . . 0.0 112.206 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -111.05 -5.19 14.84 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -168.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -93.48 -17.99 22.8 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.101 0.961 . . . . 0.0 112.99 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -68.29 163.82 22.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.782 1.233 . . . . 0.0 112.096 165.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -116.78 169.75 9.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 122.454 1.121 . . . . 0.0 111.645 172.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.03 -24.44 40.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.308 1.043 . . . . 0.0 112.651 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.0 m -65.26 -45.3 85.06 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.802 1.641 . . . . 0.0 112.292 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.94 -38.23 90.28 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.517 -1.365 . . . . 0.0 111.931 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.3 -51.09 71.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.5 0.72 . . . . 0.0 112.167 172.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.5 p -65.51 -31.11 71.99 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.699 0.799 . . . . 0.0 113.116 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -70.87 -41.71 71.04 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.29 1.436 . . . . 0.0 112.602 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -96.19 -35.14 11.4 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.484 1.113 . . . . 0.0 113.416 -169.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 tt -91.64 -17.29 25.75 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.14 1.776 . . . . 0.0 112.099 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 61.01 69.96 0.64 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.212 1.805 . . . . 0.0 112.712 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.9 pt -136.79 162.89 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 128.384 2.674 . . . . 0.0 109.136 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -70.15 152.53 44.19 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.382 -0.824 . . . . 0.0 111.038 167.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 t -58.92 -36.07 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.052 0.941 . . . . 0.0 111.379 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.84 -32.26 71.82 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -69.14 -35.52 76.46 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.592 -0.718 . . . . 0.0 111.117 171.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.25 -49.74 63.23 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.767 0.712 . . . . 0.0 110.568 175.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -54.11 -42.91 69.94 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.506 1.522 . . . . 0.0 112.563 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -87.02 -32.18 20.15 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -63.04 -37.77 88.51 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.505 -1.372 . . . . 0.0 112.25 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.6 mt -49.79 -44.77 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.624 1.17 . . . . 0.0 111.739 175.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -90.0 -25.2 20.98 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 . . . . . 0 CA--C 1.543 0.696 0 CA-C-N 119.848 1.204 . . . . 0.0 112.627 174.085 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.482 1.173 0 CA-C-O 121.811 0.815 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 m120 52.61 30.8 9.12 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.514 1.526 . . . . 0.0 114.739 -175.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.94 -1.01 38.31 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -68.7 13.75 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.628 1.971 . . . . 0.0 115.758 -175.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.7 pttt -91.65 -6.54 51.97 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.075 2.55 . . . . 0.0 114.318 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 90.0 m -136.93 -42.09 0.59 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.808 1.643 . . . . 0.0 111.393 -173.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.7 pt -69.42 169.43 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 123.738 0.815 . . . . 0.0 111.384 170.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 67.53 -29.17 0.15 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.199 2.199 . . . . 0.0 115.791 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.2 ptp -94.29 -34.89 12.67 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.648 1.179 . . . . 0.0 113.606 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -90.0 -25.67 20.74 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 173.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 CA--C 1.54 0.585 0 C-N-CA 124.162 0.985 . . . . 0.0 111.924 -173.375 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 C--O 1.234 0.277 0 CA-C-O 121.593 0.711 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.9 m -114.46 -73.25 0.66 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.904 1.682 . . . . 0.0 112.855 -176.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -160.17 -32.38 0.06 Allowed 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -170.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -83.15 -27.43 30.1 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.909 0.484 . . . . 0.0 111.226 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -75.4 -42.81 52.86 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.815 1.246 . . . . 0.0 111.437 -169.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -70.8 -26.69 63.43 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.995 0.918 . . . . 0.0 112.61 174.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -66.54 -4.71 9.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 166.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.1 mt -107.09 -52.83 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.14 1.376 . . . . 0.0 110.258 166.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.82 -57.85 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.231 0.923 . . . . 0.0 111.581 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.64 67.82 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.366 0.53 . . . . 0.0 111.777 -177.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -57.85 -36.92 72.97 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 167.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -38.19 70.34 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.195 0.998 . . . . 0.0 111.852 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -58.81 -35.01 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 O-C-N 120.24 -1.538 . . . . 0.0 110.749 174.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.2 m -77.15 -4.94 47.13 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -107.26 -29.94 9.02 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.936 1.244 . . . . 0.0 113.436 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.3 p -136.21 -22.22 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 -171.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 140.05 -86.31 0.21 Allowed Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.663 1.125 . . . . 0.0 111.801 174.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.5 tp -159.54 -42.98 0.05 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.844 1.258 . . . . 0.0 112.397 174.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -117.3 2.92 12.58 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -168.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -94.95 -17.04 22.33 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.295 0.638 . . . . 0.0 112.281 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.98 161.73 18.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.122 1.369 . . . . 0.0 112.087 168.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -110.78 162.3 14.91 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.564 1.173 . . . . 0.0 111.557 168.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.81 -24.94 48.64 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.614 1.166 . . . . 0.0 112.584 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.2 m -64.02 -47.17 81.31 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.907 1.683 . . . . 0.0 111.731 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -62.59 -40.47 97.01 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.753 1.221 . . . . 0.0 113.074 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.51 -51.53 69.07 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.051 0.94 . . . . 0.0 111.278 168.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.1 m -58.76 -30.38 67.48 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.341 1.456 . . . . 0.0 113.167 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -79.4 -18.52 52.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.554 1.542 . . . . 0.0 113.511 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -110.04 -36.66 5.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.194 1.398 . . . . 0.0 113.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.24 -19.57 46.58 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.364 1.066 . . . . 0.0 112.663 171.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.12 63.12 1.48 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.175 1.39 . . . . 0.0 111.366 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.6 pt -128.34 167.28 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.544 1.938 . . . . 0.0 111.947 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.1 m -65.06 134.53 54.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.954 1.702 . . . . 0.0 109.551 165.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.77 -34.37 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 122.992 0.517 . . . . 0.0 111.742 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.2 -28.76 66.66 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 177.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -68.87 -36.95 78.72 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.272 170.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.62 -49.08 61.98 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.704 0.684 . . . . 0.0 110.437 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -53.31 -42.63 66.87 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.119 1.368 . . . . 0.0 112.594 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -87.79 -32.63 18.98 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -62.62 -38.96 92.27 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.179 -0.951 . . . . 0.0 112.228 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.6 mt -48.06 -65.6 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.013 1.325 . . . . 0.0 109.851 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.76 -28.64 67.79 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 . . . . . 0 N--CA 1.474 0.732 0 CA-C-N 120.027 1.285 . . . . 0.0 113.152 178.251 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.259 0.8 OUTLIER 46.11 26.67 0.45 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.765 2.026 . . . . 0.0 115.977 -170.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -8.28 25.42 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.719 1.208 . . . . 0.0 114.155 -175.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -72.83 15.52 0.19 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.442 1.897 . . . . 0.0 115.058 -174.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -89.32 -5.13 57.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.093 2.557 . . . . 0.0 114.726 -169.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 93.8 m -138.19 -50.47 0.58 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.206 1.802 . . . . 0.0 109.954 -171.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.2 pt -66.9 165.08 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.813 1.245 . . . . 0.0 112.279 172.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.57 -7.2 0.19 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.452 2.301 . . . . 0.0 116.018 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 47.3 mtm -93.23 -44.1 8.5 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.875 1.216 . . . . 0.0 113.518 -178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -109.85 -6.05 15.35 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 . . . . . 0 CA--C 1.542 0.654 0 C-N-CA 125.052 1.341 . . . . 0.0 112.289 177.33 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.6 mp . . . . . 0 CA--C 1.537 0.459 0 CA-C-O 121.54 0.686 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 p -95.75 -87.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.657 1.983 . . . . 0.0 111.722 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -159.34 -36.96 0.06 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.494 1.118 . . . . 0.0 112.567 -172.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.44 -33.26 73.88 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.755 0.822 . . . . 0.0 110.471 168.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -72.23 -31.31 65.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.455 1.102 . . . . 0.0 111.404 -175.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -42.49 99.38 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.291 1.036 . . . . 0.0 113.722 165.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -60.42 -9.38 3.54 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 172.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.5 mt -99.26 -57.27 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.14 1.376 . . . . 0.0 111.153 166.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.29 -55.63 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 119.573 1.078 . . . . 0.0 112.8 -172.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.04 -32.67 74.5 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.674 -0.641 . . . . 0.0 111.056 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.76 -34.26 76.86 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -36.5 63.72 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.563 1.145 . . . . 0.0 111.703 174.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.89 -33.82 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.138 -1.601 . . . . 0.0 110.389 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.1 m -79.75 -3.54 48.01 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 170.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -101.27 -40.39 7.16 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.996 1.271 . . . . 0.0 112.501 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 p -132.98 -22.8 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 -169.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 142.98 -84.9 0.19 Allowed Glycine 0 N--CA 1.469 0.883 0 C-N-CA 124.559 1.076 . . . . 0.0 111.517 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -165.6 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 111.302 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -104.85 -9.31 18.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.591 1.556 . . . . 0.0 114.771 -166.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -92.17 -16.95 25.57 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.66 0.664 . . . . 0.0 112.713 -174.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.93 161.21 18.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.334 1.454 . . . . 0.0 114.521 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.1 t-20 -100.95 123.4 45.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.011 1.324 . . . . 0.0 110.948 -177.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.55 -28.84 70.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.673 1.189 . . . . 0.0 113.022 177.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.2 m -68.33 -42.63 79.03 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.555 0.742 . . . . 0.0 111.671 176.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -62.2 -37.83 86.82 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.37 -0.831 . . . . 0.0 112.382 175.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.38 -47.37 84.45 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.692 -0.63 . . . . 0.0 111.868 168.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -60.28 -27.16 67.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -76.0 -26.65 56.93 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.252 1.821 . . . . 0.0 112.941 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -105.18 -37.62 6.84 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.367 1.467 . . . . 0.0 112.885 -177.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -17.14 53.31 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.417 1.087 . . . . 0.0 112.453 173.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 59.49 60.23 2.35 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.205 1.402 . . . . 0.0 112.079 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.6 pt -128.76 175.76 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 127.971 2.509 . . . . 0.0 109.645 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.1 t -77.09 148.64 35.97 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.407 -0.808 . . . . 0.0 110.675 163.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.93 -29.78 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.37 1.068 . . . . 0.0 111.153 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -70.63 -29.65 66.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -73.87 -37.13 64.84 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.818 -0.61 . . . . 0.0 111.183 167.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.88 -47.07 76.06 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.425 0.557 . . . . 0.0 111.006 -177.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 53.8 pttt -70.6 -20.49 62.76 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -176.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -93.41 -39.27 11.01 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.085 0.857 . . . . 0.0 112.336 171.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.69 -42.57 75.39 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.139 -0.976 . . . . 0.0 112.292 177.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mt -47.39 -63.98 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.699 1.2 . . . . 0.0 110.455 175.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.3 pttt -73.37 -32.52 64.55 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 CA--C 1.537 0.462 0 CA-C-N 118.801 0.728 . . . . 0.0 112.295 -177.364 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.68 31.91 13.62 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 114.3 -174.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.81 -9.26 23.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.778 1.231 . . . . 0.0 113.977 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -75.79 15.88 0.46 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.482 1.913 . . . . 0.0 115.05 -175.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -84.06 9.68 11.92 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.944 2.498 . . . . 0.0 115.165 -170.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -145.62 -46.5 0.21 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.397 1.879 . . . . 0.0 110.054 -168.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.1 mt -74.59 161.83 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.131 1.772 . . . . 0.0 109.289 175.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.72 -9.52 0.18 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 117.086 2.254 . . . . 0.0 117.086 177.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 36.8 mtm -93.12 -32.24 14.51 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -175.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -100.61 -10.79 20.61 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.255 1.022 . . . . 0.0 113.631 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 CA--C 1.552 1.035 0 C-N-CA 126.092 1.757 . . . . 0.0 113.185 -171.086 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.0 mp . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.4 t -82.01 -73.06 0.41 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.914 0.886 . . . . 0.0 111.899 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -162.87 -36.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.053 0.541 . . . . 0.0 112.306 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -75.25 -33.4 61.29 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.733 0.413 . . . . 0.0 111.466 171.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -69.35 -42.12 75.71 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.427 -0.795 . . . . 0.0 112.264 -171.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 ptpt -70.44 -25.58 63.26 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.2 -0.938 . . . . 0.0 113.068 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -71.89 2.48 5.46 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 166.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.9 mt -110.78 -43.22 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.572 1.549 . . . . 0.0 110.895 168.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.8 t -79.8 -63.89 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 119.176 0.898 . . . . 0.0 112.447 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.06 -28.44 68.2 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.329 -0.857 . . . . 0.0 112.456 -175.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.71 -17.39 64.07 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 168.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -34.21 17.67 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.636 1.174 . . . . 0.0 111.093 170.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.5 mm -61.69 -21.76 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 120.537 -1.352 . . . . 0.0 112.451 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.4 p -90.3 -4.83 56.88 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 171.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -93.54 -56.81 2.79 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.993 1.269 . . . . 0.0 112.517 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.0 m -117.61 -37.85 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -166.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.45 -90.77 0.13 Allowed Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.08 1.324 . . . . 0.0 112.057 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.4 tp -167.35 -47.75 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.566 1.547 . . . . 0.0 111.52 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -96.03 19.36 11.74 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.626 1.57 . . . . 0.0 113.163 -168.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -149.54 -5.02 0.38 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.808 2.043 . . . . 0.0 113.268 -159.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.91 161.66 24.26 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.086 1.354 . . . . 0.0 112.396 172.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -98.62 113.99 26.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.376 0.608 . . . . 0.0 111.327 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.64 -23.23 65.92 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.379 1.472 . . . . 0.0 113.737 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.7 m -65.74 -38.23 88.55 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.132 0.973 . . . . 0.0 112.104 174.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -69.48 -35.18 75.33 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 120.599 -1.313 . . . . 0.0 112.146 177.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.57 -54.62 43.23 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.404 0.682 . . . . 0.0 110.82 167.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.7 p -66.58 -28.43 68.51 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -61.2 -52.31 65.35 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.93 1.692 . . . . 0.0 112.473 170.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.4 mtp-105 -87.1 -35.82 18.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -172.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.72 -18.85 46.5 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.464 1.506 . . . . 0.0 111.402 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.75 65.21 0.84 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.303 1.841 . . . . 0.0 112.008 177.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.1 pt -131.24 174.01 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 127.175 2.19 . . . . 0.0 110.566 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.0 m -69.38 139.11 54.13 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.083 1.353 . . . . 0.0 109.247 165.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.2 t -57.36 -39.14 66.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.301 0.64 . . . . 0.0 111.575 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -68.53 -27.94 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.442 0.905 . . . . 0.0 113.442 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.03 -35.14 76.28 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 111.286 173.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.07 64.07 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.854 0.752 . . . . 0.0 110.469 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.23 -37.32 69.55 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.528 1.131 . . . . 0.0 112.934 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.9 t -86.87 -35.96 18.72 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -63.35 -35.42 80.33 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.041 -1.037 . . . . 0.0 112.916 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mt -48.02 -44.37 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.99 1.316 . . . . 0.0 111.442 173.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -86.42 -34.86 20.02 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 . . . . . 0 CA--C 1.543 0.702 0 CA-C-N 118.299 0.5 . . . . 0.0 112.082 -178.348 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.0 p . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 62.24 38.54 13.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 125.488 1.515 . . . . 0.0 113.18 -171.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -93.08 -2.78 55.19 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 175.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -72.46 16.25 0.15 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.407 1.883 . . . . 0.0 115.291 -175.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.0 pttp -83.84 -6.08 59.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.004 2.122 . . . . 0.0 113.655 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 61.9 m -138.24 -47.79 0.53 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.949 2.099 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.0 mt -76.83 156.0 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.776 1.23 . . . . 0.0 109.684 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 67.82 -4.43 0.98 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 127.415 2.286 . . . . 0.0 116.698 178.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 34.5 mtm -85.99 -49.08 8.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.704 1.138 . . . . 0.0 112.359 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -88.05 -19.29 27.31 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.574 1.15 . . . . 0.0 113.287 -174.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 126.18 1.792 . . . . 0.0 113.321 -172.283 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 mp . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 120.967 0.413 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -92.3 -81.94 0.33 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.998 1.319 . . . . 0.0 111.552 173.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -159.07 -29.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.66 -170.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -82.4 -31.63 29.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.204 0.602 . . . . 0.0 111.5 170.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.86 -41.66 82.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.232 -0.918 . . . . 0.0 112.288 -175.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -69.46 -26.4 64.56 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.882 -1.136 . . . . 0.0 113.116 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -69.03 -3.6 13.71 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 166.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.1 mt -100.88 -54.56 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.788 1.235 . . . . 0.0 109.82 164.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.71 -56.7 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 119.398 0.999 . . . . 0.0 112.797 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.08 -30.45 70.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.577 -0.702 . . . . 0.0 111.338 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.55 -46.1 91.45 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 167.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -36.49 82.74 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.519 1.054 . . . . 0.0 111.826 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -24.81 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 O-C-N 120.7 -1.25 . . . . 0.0 112.009 172.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -79.9 -16.2 55.82 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 171.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.96 -50.89 5.11 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.695 -1.253 . . . . 0.0 112.002 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.7 m -124.49 -12.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -167.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 122.62 -74.82 0.37 Allowed Glycine 0 N--CA 1.468 0.831 0 C-N-CA 125.546 1.546 . . . . 0.0 112.602 164.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.5 tp -166.84 -41.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.332 1.453 . . . . 0.0 112.244 175.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.0 m-80 -108.81 -6.25 15.91 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -166.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -93.74 -19.45 21.06 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.156 0.982 . . . . 0.0 113.09 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -65.93 162.48 19.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.861 1.264 . . . . 0.0 112.21 166.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -112.23 167.1 10.69 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.541 1.162 . . . . 0.0 111.876 172.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.54 -21.55 35.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.656 1.182 . . . . 0.0 112.81 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.4 m -63.88 -48.68 75.71 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.489 1.516 . . . . 0.0 111.394 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -65.12 -43.04 93.27 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.088 -1.007 . . . . 0.0 111.956 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -56.96 -54.53 45.65 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.784 0.834 . . . . 0.0 112.067 171.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -63.61 -21.83 66.57 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt -79.21 -44.8 21.12 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.837 1.255 . . . . 0.0 112.094 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -80.34 -36.55 34.02 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.65 1.18 . . . . 0.0 113.401 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 mt -87.64 -20.83 25.79 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.385 1.474 . . . . 0.0 113.167 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.85 61.25 1.96 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.27 1.428 . . . . 0.0 111.94 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -123.56 169.31 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 127.052 2.141 . . . . 0.0 110.557 174.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -65.57 138.53 58.1 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.832 1.253 . . . . 0.0 109.605 164.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 13.3 t -57.54 -38.06 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 123.407 0.683 . . . . 0.0 111.496 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -72.05 -25.93 61.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.82 -36.53 75.68 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.568 -0.729 . . . . 0.0 110.676 169.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.13 71.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.852 0.751 . . . . 0.0 110.904 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -53.59 -41.01 66.14 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.292 1.437 . . . . 0.0 112.705 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -87.63 -33.34 18.86 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -63.29 -36.16 82.74 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.809 -1.182 . . . . 0.0 112.68 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.85 -45.38 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.847 1.259 . . . . 0.0 111.448 174.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -90.74 -27.7 18.76 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 . . . . . 0 CA--C 1.543 0.704 0 CA-C-N 120.158 1.345 . . . . 0.0 112.805 176.898 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.8 p . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 122.74 1.257 . . . . 0.0 114.349 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.45 -13.82 61.95 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.756 2.022 . . . . 0.0 112.496 -173.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -60.35 -19.9 57.37 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.764 2.826 . . . . 0.0 112.874 174.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.79 18.93 0.15 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.294 1.837 . . . . 0.0 115.443 -176.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -81.78 -4.35 56.15 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -142.87 -49.09 0.34 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.108 1.763 . . . . 0.0 110.256 -167.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.9 pt -70.89 161.15 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.694 1.198 . . . . 0.0 112.22 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.29 -9.02 0.13 Allowed 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 127.202 2.201 . . . . 0.0 116.389 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 39.6 mtm -89.04 -36.44 15.79 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.871 1.214 . . . . 0.0 113.462 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -86.83 -19.11 29.44 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 124.581 1.153 . . . . 0.0 111.512 176.611 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -116.37 -72.54 0.69 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.439 1.896 . . . . 0.0 111.84 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.84 -45.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.975 0.51 . . . . 0.0 111.158 -172.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -63.48 -30.65 71.74 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.467 0.707 . . . . 0.0 110.941 174.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -69.14 -35.4 76.32 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 111.842 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -70.54 -35.66 73.26 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.394 -0.816 . . . . 0.0 112.167 170.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -62.61 -7.43 4.74 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 170.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.3 mt -102.98 -55.43 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 125.581 1.552 . . . . 0.0 110.609 170.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 39.3 t -83.9 -55.2 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -172.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.02 -30.04 70.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.874 0.761 . . . . 0.0 112.189 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.17 -38.36 79.59 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.216 0.606 . . . . 0.0 112.431 167.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.82 -36.82 78.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.263 1.025 . . . . 0.0 111.694 173.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.79 -26.66 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 120.851 -1.156 . . . . 0.0 111.555 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -81.0 -8.73 59.84 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 171.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -98.78 -57.84 2.09 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.477 1.489 . . . . 0.0 112.33 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.6 m -118.0 -18.32 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 -164.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.98 -92.27 0.27 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.73 1.634 . . . . 0.0 110.468 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -166.82 -29.41 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.197 1.799 . . . . 0.0 112.976 173.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -99.36 -14.58 19.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.399 1.48 . . . . 0.0 114.133 -176.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -93.87 -14.99 25.47 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.216 1.006 . . . . 0.0 113.413 -175.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.85 166.29 21.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.639 1.576 . . . . 0.0 114.0 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -108.88 115.63 30.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.621 1.169 . . . . 0.0 111.189 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.36 63.27 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.002 1.321 . . . . 0.0 113.775 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.9 m -65.89 -40.01 91.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.102 0.961 . . . . 0.0 111.939 175.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -66.33 -37.41 85.31 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.437 -1.414 . . . . 0.0 112.244 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.68 -50.12 73.78 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.169 0.587 . . . . 0.0 110.817 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.6 p -69.9 -29.66 66.9 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -66.19 -36.59 83.49 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.321 1.449 . . . . 0.0 112.974 173.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.4 mmt-85 -92.83 -39.29 11.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.672 1.189 . . . . 0.0 113.535 -176.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 tt -80.82 -20.2 42.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.628 1.171 . . . . 0.0 111.976 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.24 65.79 0.49 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.67 1.988 . . . . 0.0 112.403 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.6 pt -132.65 -178.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 128.118 2.567 . . . . 0.0 109.295 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -81.53 156.13 25.41 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.361 -0.837 . . . . 0.0 111.052 165.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -58.51 -39.37 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.163 0.985 . . . . 0.0 111.241 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -69.76 -26.47 64.32 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.83 -40.42 87.98 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.701 0.682 . . . . 0.0 111.186 168.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.82 -48.68 65.56 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.349 0.522 . . . . 0.0 109.903 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -53.57 -39.06 64.48 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.433 1.493 . . . . 0.0 112.707 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -84.65 -41.77 16.0 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.851 0.75 . . . . 0.0 112.509 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.59 -35.98 77.44 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.14 -0.975 . . . . 0.0 113.129 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.2 mt -47.62 -51.65 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.297 1.439 . . . . 0.0 111.342 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -85.35 -33.46 22.04 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -176.522 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.481 1.081 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 57.11 5.61 0.27 Allowed 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 -174.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -3.06 50.75 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 119.749 -1.844 . . . . 0.0 114.186 -170.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -70.06 12.76 0.19 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.934 2.094 . . . . 0.0 115.077 -176.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -86.04 -15.42 41.38 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.873 1.669 . . . . 0.0 113.883 -173.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.5 m -123.37 -42.88 2.21 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.167 1.787 . . . . 0.0 110.857 -171.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -72.33 166.61 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 124.612 1.165 . . . . 0.0 108.783 167.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? 67.58 -8.31 0.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.996 2.119 . . . . 0.0 116.138 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.26 -10.4 8.96 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -114.9 -14.91 11.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -161.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.477 0.903 0 C-N-CA 124.963 1.305 . . . . 0.0 114.116 179.411 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -105.21 -70.82 0.76 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 110.995 168.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -163.82 -43.34 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.715 0.806 . . . . 0.0 110.715 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.8 10.82 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.278 1.431 . . . . 0.0 112.799 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -111.89 -46.95 3.18 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.793 1.237 . . . . 0.0 112.482 175.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -67.44 -25.67 66.02 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.746 -1.221 . . . . 0.0 112.641 175.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -65.88 -10.63 40.16 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.491 1.517 . . . . 0.0 113.713 168.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.43 -57.01 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 125.158 1.383 . . . . 0.0 110.226 165.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.2 t -71.27 -49.45 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.064 1.302 . . . . 0.0 112.955 -168.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.1 87.33 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.757 0.708 . . . . 0.0 110.98 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.89 -38.54 82.56 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.21 -34.57 63.76 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.928 0.891 . . . . 0.0 112.346 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.99 -36.04 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.227 -0.921 . . . . 0.0 111.239 170.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.9 m -73.42 -13.41 61.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 172.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -100.8 -40.41 7.33 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.767 1.167 . . . . 0.0 112.323 -172.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.8 m -134.62 -22.47 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -175.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 93.71 135.62 7.66 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 119.619 1.099 . . . . 0.0 111.772 -172.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.15 -25.02 1.3 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 128.167 2.587 . . . . 0.0 114.869 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -89.05 -14.86 35.42 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.158 1.383 . . . . 0.0 113.66 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -114.66 -21.53 10.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.863 1.265 . . . . 0.0 113.47 -172.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.2 169.99 11.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.626 1.171 . . . . 0.0 112.738 171.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p30 -113.25 168.95 9.3 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.036 0.922 . . . . 0.0 111.387 169.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.03 -23.45 35.9 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.217 1.007 . . . . 0.0 112.702 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 m -61.53 -44.62 96.72 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.941 1.696 . . . . 0.0 112.254 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -65.7 -34.04 77.28 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.652 -1.28 . . . . 0.0 112.763 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.54 -51.43 50.89 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.514 0.597 . . . . 0.0 111.483 172.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.4 p -61.98 -18.15 59.44 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -84.19 -32.28 24.66 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.82 1.248 . . . . 0.0 112.826 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -102.69 -36.08 8.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.016 1.326 . . . . 0.0 113.205 -175.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.16 -16.2 41.2 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.679 1.192 . . . . 0.0 113.197 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.25 47.63 13.87 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-O 122.78 1.276 . . . . 0.0 111.628 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.7 pt -110.82 160.0 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 127.969 2.507 . . . . 0.0 109.795 175.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.2 t -68.25 152.04 46.05 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.496 -0.753 . . . . 0.0 110.809 167.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.8 t -58.09 -36.67 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.001 0.92 . . . . 0.0 111.287 -176.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -69.53 -32.25 70.96 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -67.91 -38.87 83.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.787 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.27 -48.79 71.97 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.628 0.649 . . . . 0.0 110.471 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -54.57 -42.34 70.89 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.469 1.507 . . . . 0.0 112.746 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -87.43 -33.37 19.1 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -64.39 -37.33 87.12 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.802 0.841 . . . . 0.0 112.395 177.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.2 mt -48.03 -50.68 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.49 1.116 . . . . 0.0 111.02 174.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -84.64 -30.31 25.0 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 . . . . . 0 CA--C 1.543 0.68 0 CA-C-N 119.769 1.168 . . . . 0.0 113.391 179.907 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.482 1.135 0 CA-C-O 121.934 0.873 . . . . 0.0 112.825 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 54.8 31.19 15.08 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.788 2.035 . . . . 0.0 113.955 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -90.65 -10.82 41.8 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -175.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -76.01 9.83 2.23 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.186 1.794 . . . . 0.0 115.611 -162.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -11.05 58.77 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.421 1.888 . . . . 0.0 114.461 -177.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 89.5 m -138.15 -41.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.59 1.556 . . . . 0.0 111.012 -162.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.7 pt -68.03 171.57 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.786 0.834 . . . . 0.0 111.349 171.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? 66.76 -20.18 0.11 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 127.033 2.133 . . . . 0.0 116.054 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 -9.71 11.18 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -111.7 -28.81 7.95 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 -166.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 . . . . . 0 CA--C 1.543 0.676 0 C-N-CA 124.492 1.117 . . . . 0.0 112.315 177.852 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.535 0.366 0 CA-C-O 121.502 0.668 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -119.24 -68.12 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.428 1.891 . . . . 0.0 112.415 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -164.56 -39.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -173.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -67.84 -29.94 69.2 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.437 0.695 . . . . 0.0 110.714 171.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -75.2 -35.49 61.5 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.153 0.981 . . . . 0.0 111.909 -173.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -66.58 -36.64 83.11 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.244 -0.91 . . . . 0.0 112.874 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.49 -4.68 2.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 170.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mt -109.78 -52.6 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 125.415 1.486 . . . . 0.0 110.816 168.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.5 t -68.06 -63.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.738 0.815 . . . . 0.0 111.563 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.88 69.39 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.098 0.559 . . . . 0.0 111.583 -175.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -58.03 -37.23 73.95 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.62 -35.52 62.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.884 1.274 . . . . 0.0 111.789 173.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.17 -34.54 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.069 -1.644 . . . . 0.0 110.566 173.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -78.7 -1.97 37.04 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 169.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -101.28 -45.5 5.32 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 120.013 1.279 . . . . 0.0 112.55 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.95 -12.37 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.4 -78.51 0.36 Allowed Glycine 0 N--CA 1.469 0.845 0 C-N-CA 125.161 1.363 . . . . 0.0 111.971 166.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.5 tt -161.19 -48.92 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.762 1.225 . . . . 0.0 112.066 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -95.71 -17.93 20.88 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.202 1.801 . . . . 0.0 114.391 -171.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -85.73 -14.29 45.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -167.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 170.77 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.656 1.583 . . . . 0.0 112.761 168.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -124.42 166.22 16.36 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.558 1.17 . . . . 0.0 112.659 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.54 -28.62 56.37 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.134 1.374 . . . . 0.0 112.551 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -64.44 -46.05 84.86 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.388 1.475 . . . . 0.0 112.039 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -61.44 -50.87 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.628 0.771 . . . . 0.0 111.597 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.0 mt -54.51 -42.32 70.68 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.563 -0.711 . . . . 0.0 111.63 176.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 m -60.84 -28.65 68.99 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.209 1.403 . . . . 0.0 113.876 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -85.92 -31.44 22.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.237 1.415 . . . . 0.0 112.588 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -96.68 -33.54 11.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.448 1.099 . . . . 0.0 113.009 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.9 mt -89.8 -17.1 28.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.925 1.29 . . . . 0.0 113.479 175.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.54 54.33 3.08 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 122.843 1.306 . . . . 0.0 112.684 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.2 pt -119.26 164.96 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 126.923 2.089 . . . . 0.0 110.379 175.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.9 t -74.28 147.99 41.84 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 121.796 -0.565 . . . . 0.0 110.866 166.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.3 t -54.49 -30.66 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.134 1.374 . . . . 0.0 111.08 176.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.55 -27.04 61.13 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -81.33 -32.71 32.89 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.361 0.982 . . . . 0.0 111.15 167.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.42 74.51 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.969 0.804 . . . . 0.0 111.462 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -68.16 -25.96 65.52 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -94.4 -33.39 13.17 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -57.56 -44.22 85.11 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.214 -0.929 . . . . 0.0 111.852 175.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.8 mt -47.3 -60.72 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.989 1.316 . . . . 0.0 110.631 176.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -77.21 -18.65 57.55 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -175.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 . . . . . 0 N--CA 1.471 0.621 0 CA-C-N 119.583 1.083 . . . . 0.0 112.648 174.929 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.7 p . . . . . 0 N--CA 1.482 1.156 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.9 m120 60.94 16.65 7.13 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -76.76 -8.71 57.81 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.643 -1.286 . . . . 0.0 114.196 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -70.38 13.45 0.17 Allowed 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 125.815 1.646 . . . . 0.0 114.262 176.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -85.67 -12.54 51.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.601 2.36 . . . . 0.0 112.878 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 36.3 m -130.42 -42.6 1.18 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.204 1.802 . . . . 0.0 111.269 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.2 mt -71.46 156.45 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.312 1.045 . . . . 0.0 108.34 166.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 65.01 -6.1 0.36 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 117.368 2.358 . . . . 0.0 117.368 171.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -83.6 -28.91 28.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.486 1.039 . . . . 0.0 113.391 175.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -108.62 -14.87 14.54 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.901 1.281 . . . . 0.0 113.43 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 . . . . . 0 CA--C 1.542 0.667 0 C-N-CA 126.239 1.815 . . . . 0.0 112.501 -174.476 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.719 0 CA-C-O 122.163 0.982 . . . . 0.0 113.218 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.1 m -147.58 90.17 1.83 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.163 2.185 . . . . 0.0 111.322 -171.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.84 5.74 3.59 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 161.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -128.49 -38.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.719 1.207 . . . . 0.0 111.05 172.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -74.74 -32.95 62.26 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.149 1.38 . . . . 0.0 111.942 -173.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -67.9 -36.41 80.16 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.299 -0.875 . . . . 0.0 112.241 171.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -63.29 -4.98 2.92 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 170.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.2 mt -109.54 -15.8 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.052 1.741 . . . . 0.0 112.563 174.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.0 t -128.78 -55.86 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 119.316 0.962 . . . . 0.0 112.904 -172.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.73 -40.67 95.9 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.643 1.11 . . . . 0.0 111.124 173.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -66.49 -27.53 67.86 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 172.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.11 -38.48 56.86 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.303 1.041 . . . . 0.0 111.682 175.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.64 -34.28 54.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.826 -1.171 . . . . 0.0 110.642 169.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -72.44 -10.84 60.29 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -106.78 -42.35 4.97 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.423 1.465 . . . . 0.0 112.894 -173.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -127.18 -14.88 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -173.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.07 -79.67 0.35 Allowed Glycine 0 N--CA 1.468 0.768 0 C-N-CA 125.373 1.463 . . . . 0.0 112.044 165.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tt -164.05 -46.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.945 1.298 . . . . 0.0 112.042 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -98.79 -17.2 18.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.316 1.846 . . . . 0.0 114.531 -172.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -87.15 -14.5 41.07 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -68.78 165.98 18.51 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.342 1.457 . . . . 0.0 112.085 166.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -119.81 169.62 9.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.284 1.04 . . . . 0.0 111.831 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.66 -23.18 42.68 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.388 1.075 . . . . 0.0 112.824 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.3 m -67.41 -46.25 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.827 1.651 . . . . 0.0 112.15 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.16 -29.87 69.68 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 120.453 -1.405 . . . . 0.0 112.829 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.83 -54.56 18.1 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.429 1.091 . . . . 0.0 112.031 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.3 p -60.63 -30.17 69.7 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.732 0.813 . . . . 0.0 112.989 -177.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -69.34 -45.12 70.2 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.374 1.47 . . . . 0.0 113.388 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 75.8 mtt85 -95.6 -36.74 11.14 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.23 -15.65 46.09 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.431 1.493 . . . . 0.0 111.18 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.99 60.2 2.2 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.229 1.812 . . . . 0.0 112.155 175.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.0 pt -128.88 162.15 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 128.209 2.603 . . . . 0.0 109.408 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.8 t -68.29 151.5 46.82 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.499 -0.75 . . . . 0.0 110.666 167.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -58.7 -36.03 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.84 0.856 . . . . 0.0 111.007 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.43 -32.59 73.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 177.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.6 mttt -66.4 -37.52 85.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.6 -0.714 . . . . 0.0 111.064 170.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.83 62.19 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.791 0.723 . . . . 0.0 110.28 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -56.52 -35.28 67.9 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.845 1.658 . . . . 0.0 113.403 178.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -86.95 -43.03 12.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.933 0.788 . . . . 0.0 112.634 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.43 -37.58 78.45 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.735 1.152 . . . . 0.0 113.142 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -47.49 -57.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.544 1.137 . . . . 0.0 110.882 173.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.2 pttm -78.88 -35.13 44.15 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 . . . . . 0 CA--C 1.543 0.69 0 CA-C-N 119.149 0.886 . . . . 0.0 112.739 -178.157 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 55.98 9.93 0.52 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.71 2.004 . . . . 0.0 115.728 -172.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.36 10.05 37.68 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.316 1.446 . . . . 0.0 114.246 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.6 p90 -68.75 18.18 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 127.036 2.134 . . . . 0.0 114.717 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -76.97 -25.96 53.39 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.32 2.248 . . . . 0.0 111.474 -177.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 86.1 m -131.11 -42.98 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.892 2.077 . . . . 0.0 111.367 -169.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 mt -76.22 159.21 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.54 1.136 . . . . 0.0 108.859 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 66.93 -22.81 0.11 Allowed 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 127.559 2.344 . . . . 0.0 116.227 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -23.48 26.52 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.798 1.181 . . . . 0.0 114.079 -168.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -107.87 -11.09 15.42 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -171.246 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--O 1.233 0.23 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -129.17 -69.12 0.71 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.934 0.893 . . . . 0.0 112.551 -176.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -156.35 -20.35 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -166.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -93.04 -31.79 14.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.328 0.651 . . . . 0.0 111.465 168.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -79.25 -43.34 23.94 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.804 . . . . 0.0 112.626 -166.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -69.64 -23.47 63.49 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.26 -0.9 . . . . 0.0 112.533 174.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -68.61 -3.7 12.78 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 164.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -106.01 -50.37 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.173 1.389 . . . . 0.0 109.856 165.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 47.5 t -66.69 -62.2 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.417 1.008 . . . . 0.0 111.558 -174.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.75 64.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.907 -0.496 . . . . 0.0 111.944 -175.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -57.15 -39.57 75.49 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 167.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.68 -34.39 64.87 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.221 1.008 . . . . 0.0 112.075 175.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -62.52 -34.26 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 O-C-N 120.656 -1.278 . . . . 0.0 110.081 173.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.4 t -75.32 -10.33 59.37 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 170.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -99.22 -43.9 6.45 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.342 -1.474 . . . . 0.0 112.534 -173.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.4 m -132.51 -11.81 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -171.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.02 -77.73 0.39 Allowed Glycine 0 N--CA 1.471 0.993 0 C-N-CA 125.031 1.3 . . . . 0.0 112.478 165.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 tp -161.88 -44.0 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.763 1.225 . . . . 0.0 112.159 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -109.6 -8.35 14.99 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.299 1.439 . . . . 0.0 114.25 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -89.08 -14.24 36.78 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 112.838 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.36 166.35 18.8 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.065 1.346 . . . . 0.0 112.339 167.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -124.04 165.5 17.37 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.585 1.183 . . . . 0.0 112.33 173.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.55 60.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.592 1.157 . . . . 0.0 112.932 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -65.11 -44.96 87.05 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.454 1.501 . . . . 0.0 111.942 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.27 -32.0 73.42 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.566 -1.334 . . . . 0.0 112.76 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tp -72.51 -47.89 44.88 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.302 0.641 . . . . 0.0 111.555 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.5 p -63.46 -28.68 70.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.443 1.097 . . . . 0.0 113.077 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.71 -37.3 76.5 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.844 1.258 . . . . 0.0 113.34 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -104.4 -33.21 8.69 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -175.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 tt -84.89 -17.69 37.11 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 176.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.89 69.51 0.67 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.43 1.892 . . . . 0.0 112.373 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -134.45 168.9 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.019 2.127 . . . . 0.0 111.254 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.6 m -69.7 136.92 51.6 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.893 1.277 . . . . 0.0 110.042 166.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.2 t -58.09 -35.48 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.169 0.988 . . . . 0.0 111.832 -178.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -69.95 -26.59 64.19 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -78.75 -33.36 46.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.891 169.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -49.47 68.66 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.749 0.704 . . . . 0.0 110.716 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -67.54 -21.04 65.48 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 t -96.33 -35.13 11.32 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.939 0.791 . . . . 0.0 113.047 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -57.72 -43.32 85.2 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.874 0.87 . . . . 0.0 111.935 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.2 mt -46.39 -62.51 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.076 1.35 . . . . 0.0 110.653 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -81.03 5.34 16.76 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 . . . . . 0 CA--C 1.543 0.681 0 C-N-CA 124.275 1.03 . . . . 0.0 112.766 169.757 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.277 0.7 OUTLIER 47.86 25.05 0.67 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.47 1.908 . . . . 0.0 115.324 -170.665 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.65 -3.56 49.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.615 1.166 . . . . 0.0 113.71 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -75.02 18.77 0.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.839 2.056 . . . . 0.0 114.333 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -68.97 -16.76 63.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.543 2.337 . . . . 0.0 114.003 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 t -144.11 -19.26 0.57 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.582 1.553 . . . . 0.0 113.19 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.98 156.54 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 126.029 1.732 . . . . 0.0 108.896 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.3 -0.38 0.67 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -171.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.5 ptm -125.1 -3.04 7.6 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.298 1.439 . . . . 0.0 114.5 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -129.28 -19.68 3.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -163.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 . . . . . 0 CA--C 1.542 0.643 0 C-N-CA 124.829 1.252 . . . . 0.0 112.371 -179.01 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 CA--C 1.535 0.39 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.1 t -140.6 -62.79 0.49 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.769 1.228 . . . . 0.0 114.084 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -161.11 -26.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -165.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -105.11 12.26 32.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.658 1.583 . . . . 0.0 111.351 176.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -118.7 -48.98 2.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.193 0.997 . . . . 0.0 112.354 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -22.71 65.68 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.512 -1.367 . . . . 0.0 112.891 171.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -66.47 -11.11 50.59 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 169.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.2 mp -95.01 -60.73 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.54 1.536 . . . . 0.0 108.145 169.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.5 t -77.32 -50.77 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.32 65.09 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.563 -0.711 . . . . 0.0 111.924 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -72.97 -35.29 66.87 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.163 1.385 . . . . 0.0 113.313 168.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.35 -36.98 84.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.822 -1.174 . . . . 0.0 111.58 174.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.18 -21.62 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 O-C-N 121.103 -0.998 . . . . 0.0 111.596 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.0 m -89.68 -5.32 57.17 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.746 1.219 . . . . 0.0 114.121 169.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -111.62 -33.21 6.42 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.958 1.254 . . . . 0.0 113.243 -173.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -138.11 -14.16 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 114.911 1.448 . . . . 0.0 114.911 -177.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.86 -80.82 0.34 Allowed Glycine 0 N--CA 1.469 0.885 0 C-N-CA 125.135 1.35 . . . . 0.0 112.538 167.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 57.3 tp -168.88 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.153 1.781 . . . . 0.0 111.559 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -116.49 -5.07 11.72 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -165.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.4 m-80 -99.41 -18.74 17.33 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 118.603 0.638 . . . . 0.0 112.671 -178.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pp -65.94 158.01 29.21 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.169 1.388 . . . . 0.0 112.227 170.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -113.02 171.17 7.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.338 1.066 . . . . 0.0 111.661 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.29 -19.88 30.88 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.609 1.164 . . . . 0.0 112.798 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -67.59 -45.92 74.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.031 1.732 . . . . 0.0 112.257 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -65.83 -37.91 87.51 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.698 -1.251 . . . . 0.0 111.983 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.56 -52.93 62.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.69 0.796 . . . . 0.0 111.981 172.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.5 p -62.83 -22.69 66.83 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.044 0.938 . . . . 0.0 113.193 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.8 mttm -77.84 -42.53 33.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.631 1.573 . . . . 0.0 112.598 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -86.55 -38.56 17.06 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.167 0.987 . . . . 0.0 113.231 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 53.1 mt -88.51 -17.6 29.96 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.67 1.188 . . . . 0.0 113.186 -175.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.21 33.3 21.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 125.326 1.45 . . . . 0.0 113.168 -178.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.7 pt -89.86 163.94 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.772 2.029 . . . . 0.0 110.46 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.0 t -72.39 151.7 42.48 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 121.578 -0.702 . . . . 0.0 110.926 165.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.4 t -57.4 -35.15 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 124.584 1.153 . . . . 0.0 111.372 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -71.73 -32.57 67.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 178.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -69.15 -36.43 77.41 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.789 169.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.6 70.61 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.199 0.909 . . . . 0.0 110.705 176.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -54.19 -42.06 69.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.017 1.727 . . . . 0.0 113.128 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.1 t -85.17 -39.53 17.75 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -59.53 -37.71 79.08 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.804 -1.185 . . . . 0.0 112.893 178.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.0 mt -48.2 -42.07 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.57 1.148 . . . . 0.0 111.914 174.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -95.19 -39.33 10.15 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.7 m120 . . . . . 0 CA--C 1.543 0.706 0 O-C-N 121.221 -0.925 . . . . 0.0 113.42 -175.719 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.42 27.29 4.79 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.429 1.892 . . . . 0.0 113.757 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.03 -16.41 22.73 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.146 0.978 . . . . 0.0 113.324 -179.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -74.38 12.35 0.78 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.655 1.982 . . . . 0.0 115.435 -171.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 6.5 47.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.076 2.151 . . . . 0.0 114.795 -167.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 96.8 m -142.88 -46.59 0.31 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.032 1.733 . . . . 0.0 110.135 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.7 pt -73.87 170.74 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.279 1.432 . . . . 0.0 111.955 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 64.97 -3.79 0.55 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.613 1.965 . . . . 0.0 116.17 176.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 21.6 ptt? -140.23 18.84 2.42 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -144.28 -31.83 0.44 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 . . . . . 0 CA--C 1.546 0.799 0 C-N-CA 125.293 1.437 . . . . 0.0 113.224 175.844 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 121.931 0.872 . . . . 0.0 112.07 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.9 t -99.16 -72.0 0.67 Allowed 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 125.587 1.555 . . . . 0.0 111.652 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -161.41 -46.56 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.949 0.499 . . . . 0.0 110.631 -174.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -56.11 -38.47 70.8 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.997 0.919 . . . . 0.0 110.469 172.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -67.37 -36.7 81.89 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.773 1.229 . . . . 0.0 111.8 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mtmt -69.07 -37.5 78.51 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 121.387 -0.821 . . . . 0.0 112.144 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -65.17 -2.44 2.92 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 170.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.7 mt -103.45 -60.98 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.253 1.421 . . . . 0.0 110.411 161.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.0 t -74.52 -53.58 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 CA-C-N 119.776 1.171 . . . . 0.0 113.128 -168.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.98 -34.3 78.11 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.579 -0.7 . . . . 0.0 110.853 177.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.96 -34.04 75.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 170.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.02 75.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.082 -1.011 . . . . 0.0 111.954 174.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.52 -32.17 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.171 -0.956 . . . . 0.0 110.697 172.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.5 m -74.96 -11.64 60.16 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -105.08 -39.45 6.22 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.291 1.405 . . . . 0.0 112.899 -172.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.6 p -129.35 -15.88 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -170.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.81 -85.43 0.23 Allowed Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.726 1.155 . . . . 0.0 111.919 171.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.3 tt -165.88 -41.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.727 1.611 . . . . 0.0 111.142 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -110.32 -6.68 14.94 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.883 1.673 . . . . 0.0 115.305 -169.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -95.89 -14.17 23.36 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 -173.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.88 159.69 24.95 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.349 1.459 . . . . 0.0 114.688 -178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.7 t-20 -101.0 122.86 44.28 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.961 1.304 . . . . 0.0 111.474 -177.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.98 -21.13 64.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.866 1.266 . . . . 0.0 113.479 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 93.5 m -66.24 -41.33 90.18 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.399 -0.813 . . . . 0.0 111.491 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.91 -43.07 99.61 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.05 -1.031 . . . . 0.0 111.721 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -57.92 -44.56 86.91 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 112.286 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 p -61.86 -27.14 68.57 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.254 -0.904 . . . . 0.0 113.3 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -84.16 -38.5 20.58 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.807 1.643 . . . . 0.0 111.91 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.2 mmt-85 -91.17 -34.67 14.93 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.041 1.336 . . . . 0.0 114.276 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -92.96 -12.69 30.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.364 1.065 . . . . 0.0 112.937 174.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.73 65.33 1.25 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.056 1.343 . . . . 0.0 112.045 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -133.19 163.06 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.601 1.96 . . . . 0.0 111.586 -177.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.5 m -57.43 134.31 55.95 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.912 1.285 . . . . 0.0 109.65 163.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.8 t -59.1 -34.58 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 121.569 -0.707 . . . . 0.0 111.389 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.06 -29.01 64.78 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.249 -0.907 . . . . 0.0 113.363 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.71 -36.36 78.34 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.896 169.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.83 -50.13 65.72 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.08 0.855 . . . . 0.0 110.811 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -54.78 -38.83 67.73 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.195 1.398 . . . . 0.0 112.815 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.4 t -88.15 -34.98 17.67 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 177.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.64 -38.01 83.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.085 -1.009 . . . . 0.0 112.266 177.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.8 mt -48.01 -60.07 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.813 1.245 . . . . 0.0 110.954 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -75.04 -21.9 58.76 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 . . . . . 0 CA--C 1.543 0.706 0 CA-C-N 119.023 0.829 . . . . 0.0 112.83 176.367 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 53.91 21.51 2.85 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 125.698 1.599 . . . . 0.0 114.926 -172.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . 0.262 0.0 OUTLIER -101.9 27.6 6.39 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 120.042 -1.661 . . . . 0.0 113.07 -172.167 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -114.63 9.95 16.64 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.51 1.524 . . . . 0.0 113.809 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.0 pttt -93.91 -20.85 19.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.399 1.879 . . . . 0.0 115.041 -158.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 m -154.57 -51.48 0.09 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.335 1.854 . . . . 0.0 110.494 -169.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.7 pt -72.02 -174.66 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 111.382 171.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 65.03 -27.2 0.1 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.499 2.32 . . . . 0.0 116.386 -172.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -87.74 -18.57 29.15 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.943 1.247 . . . . 0.0 114.021 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -116.68 3.62 13.06 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.788 1.235 . . . . 0.0 114.135 178.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 . . . . . 0 N--CA 1.472 0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 112.782 -173.116 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 CA--C 1.535 0.374 0 CA-C-O 122.05 0.928 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.3 p -106.52 -83.05 0.53 Allowed 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.76 2.424 . . . . 0.0 111.688 -178.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -155.48 -48.97 0.08 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 124.664 1.186 . . . . 0.0 110.774 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.36 -28.55 69.36 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.497 0.719 . . . . 0.0 110.958 172.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -68.69 -37.1 79.3 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.231 1.012 . . . . 0.0 111.775 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -69.24 -34.06 74.24 Favored 'General case' 0 N--CA 1.481 1.112 0 O-C-N 120.788 -1.195 . . . . 0.0 112.971 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -63.56 -3.67 2.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 169.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.6 mt -109.01 -49.67 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.674 1.59 . . . . 0.0 110.687 168.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.96 -65.1 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.71 1.141 . . . . 0.0 112.321 -177.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.28 73.71 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.668 0.787 . . . . 0.0 111.439 -173.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.7 -43.17 94.18 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 170.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -72.0 -35.78 69.56 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.229 -0.92 . . . . 0.0 112.086 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.63 -29.16 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.916 1.286 . . . . 0.0 111.536 170.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.0 t -77.06 -17.46 58.75 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 173.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -95.55 -50.14 5.09 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.704 -1.247 . . . . 0.0 111.996 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.03 -7.1 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -168.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 116.19 -76.08 0.27 Allowed Glycine 0 N--CA 1.467 0.765 0 C-N-CA 125.476 1.512 . . . . 0.0 112.83 163.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -175.05 -33.85 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 127.031 2.133 . . . . 0.0 111.186 179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -111.72 -6.1 14.37 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.175 1.39 . . . . 0.0 114.536 -165.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -97.32 -21.33 17.29 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.159 0.984 . . . . 0.0 113.236 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.2 pp -68.09 167.05 14.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.53 0.732 . . . . 0.0 112.383 167.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -128.07 170.11 13.3 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.501 1.144 . . . . 0.0 112.28 174.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.94 -32.54 61.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.061 1.344 . . . . 0.0 112.947 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.42 -52.29 64.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.006 1.322 . . . . 0.0 111.149 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.29 -34.28 77.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.066 0.946 . . . . 0.0 112.341 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 tp -66.92 -47.98 70.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.008 0.523 . . . . 0.0 111.361 173.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -60.18 -25.36 65.51 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.853 1.261 . . . . 0.0 113.98 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -82.13 -16.73 48.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.006 1.723 . . . . 0.0 113.434 -177.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -119.85 -42.46 2.61 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.77 1.628 . . . . 0.0 112.137 -175.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tp -76.39 -12.42 60.05 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.371 1.868 . . . . 0.0 112.454 172.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.31 64.56 1.34 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.344 1.858 . . . . 0.0 112.592 170.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.8 pt -139.11 174.74 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 127.588 2.355 . . . . 0.0 109.966 -176.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.8 t -75.8 151.59 37.49 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.532 -0.73 . . . . 0.0 110.769 163.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.9 t -60.57 -34.28 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.025 0.93 . . . . 0.0 111.293 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.19 -31.92 72.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -69.23 -35.69 76.42 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.19 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.31 -45.13 73.81 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.02 0.827 . . . . 0.0 110.946 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.78 -39.12 73.5 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.079 1.351 . . . . 0.0 112.813 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -87.3 -40.38 14.54 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.21 -41.65 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.063 -1.023 . . . . 0.0 112.241 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.3 mt -54.68 -36.94 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 124.311 1.044 . . . . 0.0 112.695 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -92.93 -34.6 13.72 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.948 1.249 . . . . 0.0 113.001 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 . . . . . 0 CA--C 1.541 0.635 0 C-N-CA 123.162 0.585 . . . . 0.0 112.536 -170.796 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.8 t . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 122.429 1.109 . . . . 0.0 112.865 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 m120 53.46 20.1 1.91 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.08 2.152 . . . . 0.0 115.894 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -87.72 -4.85 58.89 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.086 1.354 . . . . 0.0 113.85 -175.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -75.93 8.79 2.83 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.484 1.914 . . . . 0.0 115.004 -166.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -85.73 -7.11 58.98 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.918 1.687 . . . . 0.0 114.704 -170.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.5 m -139.39 -43.89 0.45 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.216 1.807 . . . . 0.0 110.315 -165.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 40.1 pt -64.94 172.23 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.832 0.853 . . . . 0.0 111.92 170.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? 66.07 -18.28 0.11 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 127.387 2.275 . . . . 0.0 116.734 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.47 -15.55 8.02 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.402 1.456 . . . . 0.0 114.531 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -104.28 -25.36 12.91 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -165.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? . . . . . 0 CA--C 1.543 0.68 0 C-N-CA 123.7 0.8 . . . . 0.0 112.477 -176.632 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.3 mp . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.6 p -98.01 -71.16 0.7 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.375 1.07 . . . . 0.0 111.869 172.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -159.69 -29.05 0.06 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -170.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -85.86 -28.92 24.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.165 0.586 . . . . 0.0 110.684 173.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -78.03 -39.32 42.38 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.242 -0.911 . . . . 0.0 111.257 -167.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -68.34 -29.92 68.76 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.746 0.818 . . . . 0.0 112.566 171.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.11 -7.62 13.11 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -103.29 -56.47 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.956 1.302 . . . . 0.0 109.763 167.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -66.6 -55.84 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.753 1.16 . . . . 0.0 112.198 -173.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.92 78.93 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.739 -0.601 . . . . 0.0 111.253 -176.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -60.03 -42.72 95.0 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 170.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.21 -36.13 76.94 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.309 1.044 . . . . 0.0 112.047 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -58.81 -35.62 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 O-C-N 120.859 -1.151 . . . . 0.0 111.399 174.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.6 m -70.45 -12.3 61.49 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 173.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -91.69 -43.73 9.42 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.14 1.337 . . . . 0.0 112.178 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.1 -10.71 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -165.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 125.02 -79.36 0.36 Allowed Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.714 1.149 . . . . 0.0 111.696 170.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -171.23 -43.84 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.559 1.944 . . . . 0.0 111.438 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -106.73 -12.04 15.64 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.996 1.719 . . . . 0.0 114.667 -167.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -90.12 -21.7 22.13 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -175.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.07 164.59 8.2 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.664 1.186 . . . . 0.0 113.224 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.97 164.9 12.87 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.383 1.087 . . . . 0.0 112.139 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.88 -29.38 44.39 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.707 1.203 . . . . 0.0 113.269 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -59.81 -43.58 94.42 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 0.0 111.767 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.92 -25.81 65.66 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.637 -1.29 . . . . 0.0 113.545 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.75 -50.32 17.79 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.978 0.808 . . . . 0.0 111.445 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.3 p -59.94 -26.06 65.67 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -76.24 -26.79 56.37 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 114.074 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 78.8 mtt85 -113.87 -39.35 4.0 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.078 1.351 . . . . 0.0 113.112 -172.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 tt -84.08 -19.35 34.45 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.404 1.881 . . . . 0.0 111.112 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 60.32 72.71 0.51 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.706 2.002 . . . . 0.0 112.473 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.8 pt -135.28 164.4 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 127.367 2.267 . . . . 0.0 110.356 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.5 m -62.9 140.35 58.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.739 1.216 . . . . 0.0 109.913 166.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.9 t -57.54 -38.65 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 O-C-N 121.483 -0.76 . . . . 0.0 111.436 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.06 -26.79 60.59 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.447 -0.783 . . . . 0.0 113.102 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.39 -37.54 80.47 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 118.104 -0.95 . . . . 0.0 110.597 167.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.0 -47.51 74.24 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.286 0.948 . . . . 0.0 111.54 176.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.74 -43.77 85.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.931 1.292 . . . . 0.0 112.498 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -84.62 -34.34 23.13 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -55.37 -48.36 74.4 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.376 1.07 . . . . 0.0 111.266 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.7 mt -46.13 -59.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.752 1.221 . . . . 0.0 110.472 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -87.5 -3.22 59.0 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -172.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 . . . . . 0 N--CA 1.473 0.719 0 CA-C-N 119.256 0.935 . . . . 0.0 112.66 170.596 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.4 m120 55.44 24.0 6.33 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 116.644 2.09 . . . . 0.0 116.644 168.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -108.77 -0.51 19.92 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.384 1.474 . . . . 0.0 114.038 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -76.28 19.68 0.24 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.847 1.659 . . . . 0.0 114.671 -175.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt -93.51 -2.11 54.78 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 127.103 2.161 . . . . 0.0 114.262 -162.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.1 m -148.33 -46.04 0.15 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.936 2.494 . . . . 0.0 108.763 -170.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.3 pt -73.07 161.2 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 111.424 169.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.6 mptt 61.38 18.79 9.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.526 1.53 . . . . 0.0 114.812 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 38.8 mtt -124.67 -44.96 1.94 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.833 1.253 . . . . 0.0 113.172 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -115.77 27.33 9.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.664 1.586 . . . . 0.0 112.074 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 CA--C 1.541 0.605 0 C-N-CA 126.199 1.8 . . . . 0.0 112.075 -167.489 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.468 0.459 0 CA-C-O 121.325 0.583 . . . . 0.0 111.752 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.4 m -102.71 -72.36 0.69 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.493 1.517 . . . . 0.0 112.227 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -162.47 -44.39 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.176 0.59 . . . . 0.0 111.498 -173.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -61.26 -33.78 74.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.588 0.755 . . . . 0.0 110.916 170.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -68.77 -37.58 79.45 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.626 1.171 . . . . 0.0 111.645 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt -66.32 -35.21 79.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.146 -0.972 . . . . 0.0 112.831 171.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -65.06 -1.33 2.04 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 171.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.6 mt -113.58 -14.39 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 126.354 1.862 . . . . 0.0 112.098 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -124.73 -58.96 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.124 0.97 . . . . 0.0 112.642 -174.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.15 -37.75 86.38 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.423 1.011 . . . . 0.0 111.089 175.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.21 -32.03 73.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.713 0.805 . . . . 0.0 113.049 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -77.51 -38.4 48.97 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.027 0.931 . . . . 0.0 111.871 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.14 -33.05 52.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.7 1.2 . . . . 0.0 110.462 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -71.14 -16.38 62.55 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 171.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -104.79 -42.91 5.24 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.681 -1.262 . . . . 0.0 113.024 -171.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.2 m -127.61 -13.21 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -172.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -82.52 0.31 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 125.056 1.313 . . . . 0.0 112.195 168.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 tt -171.75 -43.86 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 111.342 -178.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -112.26 -4.08 14.44 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.003 1.721 . . . . 0.0 114.932 -168.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -93.37 -22.3 19.02 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 112.792 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 pp -66.77 165.72 14.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.946 1.298 . . . . 0.0 112.313 164.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -118.24 172.53 7.38 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.394 1.093 . . . . 0.0 111.599 171.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.0 58.0 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.686 1.194 . . . . 0.0 112.815 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -65.42 -48.06 74.11 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.729 1.611 . . . . 0.0 112.194 -173.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -66.47 -29.57 69.72 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.734 -1.229 . . . . 0.0 112.686 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.29 -46.97 25.43 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.326 1.45 . . . . 0.0 110.293 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.6 p -67.89 -29.3 68.37 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.02 1.328 . . . . 0.0 113.469 177.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -66.81 -39.4 87.72 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.866 1.266 . . . . 0.0 112.675 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 83.4 mtt85 -86.99 -42.08 13.4 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.384 1.074 . . . . 0.0 113.28 -179.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 tt -81.26 -18.35 46.27 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.129 1.372 . . . . 0.0 111.829 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 62.67 68.3 0.66 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.604 1.961 . . . . 0.0 112.08 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.1 pt -135.41 177.63 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 127.231 2.213 . . . . 0.0 110.833 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.7 m -73.15 144.4 46.92 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.703 1.601 . . . . 0.0 109.813 166.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.7 t -58.79 -39.89 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 O-C-N 121.442 -0.786 . . . . 0.0 111.434 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -69.63 -30.29 67.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.0 mmtt -64.5 -38.42 90.97 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.161 170.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.61 -48.26 64.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.909 0.777 . . . . 0.0 110.216 175.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -56.34 -42.63 78.04 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.837 1.255 . . . . 0.0 112.891 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 t -82.21 -38.11 25.04 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -61.59 -36.8 81.72 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.861 -1.149 . . . . 0.0 112.937 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.3 mt -49.84 -45.77 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.154 0.981 . . . . 0.0 111.191 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -93.31 -13.0 28.71 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.259 1.578 . . . . 0.0 115.259 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.2 m120 . . . . . 0 N--CA 1.472 0.632 0 CA-C-N 119.843 1.201 . . . . 0.0 112.409 169.175 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 57.3 p . . . . . 0 N--CA 1.478 0.954 0 CA-C-O 122.779 1.276 . . . . 0.0 114.334 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -75.95 -5.28 45.47 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.62 1.568 . . . . 0.0 112.228 -171.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.94 -20.15 66.11 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 128.712 2.805 . . . . 0.0 113.592 173.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -66.66 12.56 0.07 Allowed 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.949 2.203 . . . . 0.0 116.949 -172.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -5.58 59.32 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 -169.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.7 m -139.0 -47.44 0.48 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.445 1.498 . . . . 0.0 110.806 -167.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 pt -71.12 165.1 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 124.192 0.997 . . . . 0.0 111.828 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? 65.24 -14.45 0.11 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 126.787 2.035 . . . . 0.0 116.417 176.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 49.4 mtm -85.21 -43.55 13.69 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.787 1.176 . . . . 0.0 112.783 -176.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -103.75 -7.6 20.48 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -176.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.545 0.773 0 C-N-CA 124.59 1.156 . . . . 0.0 110.757 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.649 0 CA-C-O 122.677 1.227 . . . . 0.0 113.424 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.5 t -127.72 78.96 1.86 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.041 1.737 . . . . 0.0 111.585 -161.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 59.34 18.73 6.98 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.493 1.917 . . . . 0.0 116.105 166.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -144.58 -38.88 0.28 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.124 1.77 . . . . 0.0 110.916 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -67.03 -47.2 72.14 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.298 -0.876 . . . . 0.0 111.678 -178.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -65.78 -25.77 67.41 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.86 -1.15 . . . . 0.0 113.125 171.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -69.01 -11.04 60.42 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 169.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.0 mt -95.46 -51.49 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.114 1.365 . . . . 0.0 109.82 165.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.48 -60.05 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.569 0.748 . . . . 0.0 111.829 -169.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.0 -28.55 65.6 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.167 0.44 . . . . 0.0 111.659 -176.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.28 -43.44 87.98 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 165.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -38.36 88.97 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.173 0.897 . . . . 0.0 111.836 174.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.1 mm -57.05 -35.02 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 120.473 -1.392 . . . . 0.0 111.076 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -75.61 -8.41 56.7 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.385 1.624 . . . . 0.0 115.385 173.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.51 -53.43 4.06 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.473 1.488 . . . . 0.0 111.956 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.1 m -120.77 -13.93 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 -165.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.41 -75.25 0.43 Allowed Glycine 0 N--CA 1.469 0.854 0 C-N-CA 124.57 1.081 . . . . 0.0 112.998 164.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 51.4 tp -164.94 -43.57 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.656 1.182 . . . . 0.0 112.215 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -112.4 -5.35 14.11 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.944 1.298 . . . . 0.0 114.393 -168.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -92.93 -15.1 26.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.125 0.97 . . . . 0.0 113.212 -174.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -68.25 166.42 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 166.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -115.82 167.58 10.81 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 122.48 1.133 . . . . 0.0 111.789 170.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.38 -22.89 38.02 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.402 1.081 . . . . 0.0 112.577 -179.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -66.1 -49.57 67.09 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.777 1.631 . . . . 0.0 111.441 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -64.06 -43.79 94.4 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.049 -1.032 . . . . 0.0 111.917 178.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -55.98 -58.48 7.74 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.642 0.777 . . . . 0.0 111.386 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.7 p -61.36 -21.33 63.94 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -78.81 -43.15 25.93 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.897 1.279 . . . . 0.0 112.345 175.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -79.7 -34.12 40.45 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.945 1.298 . . . . 0.0 113.234 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.8 mt -87.31 -23.8 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.955 1.702 . . . . 0.0 113.548 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.17 49.16 9.54 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.083 1.353 . . . . 0.0 112.262 -174.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.9 pt -107.24 172.44 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 126.738 2.015 . . . . 0.0 110.712 169.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 m -71.38 137.93 48.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.283 1.433 . . . . 0.0 109.538 165.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -56.28 -38.83 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.778 0.831 . . . . 0.0 111.672 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -72.92 -22.18 60.77 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -75.23 -37.07 61.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.696 166.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.9 -47.81 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.387 0.54 . . . . 0.0 110.813 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -51.46 -37.17 47.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.313 1.845 . . . . 0.0 113.567 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.5 t -96.26 -30.64 13.34 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -63.85 -32.37 73.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.003 -1.061 . . . . 0.0 112.499 174.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 33.2 mt -50.92 -27.11 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.54 1.536 . . . . 0.0 112.791 173.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -115.34 -26.02 7.76 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 176.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 . . . . . 0 CA--C 1.551 1.017 0 C-N-CA 124.906 1.282 . . . . 0.0 112.542 171.259 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.5 p . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 115.531 1.678 . . . . 0.0 115.531 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 50.85 15.01 0.21 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.434 1.893 . . . . 0.0 115.193 -164.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -14.21 58.97 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 120.018 -1.676 . . . . 0.0 113.378 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -73.88 14.94 0.33 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.841 2.056 . . . . 0.0 114.167 176.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -81.43 5.05 18.82 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.835 2.454 . . . . 0.0 114.436 -173.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 51.5 m -144.55 -46.59 0.25 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 127.066 2.146 . . . . 0.0 110.097 -170.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.5 mt -70.72 159.65 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.938 1.295 . . . . 0.0 109.223 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.5 mmtp 67.73 0.85 2.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.655 1.982 . . . . 0.0 116.211 177.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.9 mtm -106.66 -42.63 4.92 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.22 -21.48 31.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.792 0.837 . . . . 0.0 113.117 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 . . . . . 0 CA--C 1.544 0.728 0 C-N-CA 126.246 1.818 . . . . 0.0 110.939 178.21 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 121.471 0.653 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.3 t -113.25 -73.09 0.68 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.268 1.827 . . . . 0.0 112.043 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -161.86 -45.86 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.28 0.632 . . . . 0.0 111.19 -171.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.69 -32.23 73.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.534 0.734 . . . . 0.0 111.124 173.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -67.79 -35.36 78.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.129 0.972 . . . . 0.0 111.601 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -69.69 -35.07 74.76 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.295 -0.878 . . . . 0.0 112.667 171.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.71 -5.98 3.2 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.27 -24.56 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.81 1.644 . . . . 0.0 112.382 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 51.2 t -112.75 -59.59 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 124.597 1.159 . . . . 0.0 112.598 -176.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.26 -33.11 73.99 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.269 -0.894 . . . . 0.0 111.893 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -68.71 -30.85 69.58 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.182 0.993 . . . . 0.0 113.208 171.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -76.65 -37.85 55.57 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.873 1.269 . . . . 0.0 111.623 177.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.47 -40.0 65.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 O-C-N 121.062 -1.023 . . . . 0.0 110.085 167.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -73.11 -6.22 44.24 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -110.03 -30.96 7.55 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.331 1.423 . . . . 0.0 113.261 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.1 p -135.2 -16.54 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -173.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.96 -83.49 0.28 Allowed Glycine 0 N--CA 1.469 0.886 0 C-N-CA 125.098 1.332 . . . . 0.0 111.683 171.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 tt -166.31 -44.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.082 1.753 . . . . 0.0 110.551 177.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -107.55 -6.73 16.81 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.224 1.81 . . . . 0.0 115.155 -168.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.36 -16.94 24.1 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.911 0.778 . . . . 0.0 112.862 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -63.46 163.76 10.37 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.181 1.392 . . . . 0.0 112.754 167.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -112.69 170.6 8.07 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.233 1.016 . . . . 0.0 111.47 170.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -21.66 31.72 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.424 1.089 . . . . 0.0 112.72 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -65.24 -45.35 85.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.809 1.643 . . . . 0.0 112.219 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -65.46 -36.48 84.0 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.556 -1.34 . . . . 0.0 111.993 176.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 47.2 mt -65.89 -47.25 75.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.182 0.593 . . . . 0.0 112.146 173.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.8 p -63.9 -31.05 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.11 -0.994 . . . . 0.0 113.036 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -71.47 -43.6 66.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.338 1.455 . . . . 0.0 112.834 176.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -94.78 -37.11 11.41 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -86.28 -15.36 40.95 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.446 1.499 . . . . 0.0 111.568 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 59.82 67.18 0.9 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.244 1.818 . . . . 0.0 112.657 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.1 pt -136.87 161.64 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 128.399 2.68 . . . . 0.0 109.022 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.3 t -68.4 153.17 44.29 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.364 -0.835 . . . . 0.0 110.751 167.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.99 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.679 0.792 . . . . 0.0 111.126 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.06 -31.5 70.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.7 mttm -64.93 -40.69 95.44 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.62 170.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.33 -49.18 65.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.651 0.66 . . . . 0.0 110.64 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -54.35 -42.47 70.29 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.438 1.495 . . . . 0.0 112.483 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -85.15 -38.06 19.47 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.509 0.595 . . . . 0.0 112.526 -178.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -61.74 -35.73 78.93 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.054 -1.029 . . . . 0.0 112.984 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.9 mt -47.69 -55.27 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.194 0.998 . . . . 0.0 110.719 172.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -77.4 -30.32 53.53 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.3 m120 . . . . . 0 N--CA 1.472 0.653 0 CA-C-N 120.098 1.317 . . . . 0.0 112.268 175.96 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 44.75 36.73 1.93 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.095 1.758 . . . . 0.0 114.707 -168.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.27 -5.65 24.03 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.329 . . . . 0.0 113.851 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -71.63 17.25 0.09 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.634 1.974 . . . . 0.0 114.082 174.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.9 pttt -84.46 -10.4 57.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 128.056 2.542 . . . . 0.0 113.116 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 85.4 m -137.03 -42.7 0.57 Allowed 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.558 1.943 . . . . 0.0 111.24 -175.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.5 mt -71.19 153.42 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.829 0.852 . . . . 0.0 108.881 167.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm 66.68 -4.66 0.72 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 170.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -82.18 -26.89 32.99 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.939 0.79 . . . . 0.0 113.032 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -114.91 -10.67 12.29 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.063 1.345 . . . . 0.0 113.95 -175.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 . . . . . 0 N--CA 1.472 0.636 0 C-N-CA 125.406 1.482 . . . . 0.0 111.988 -179.834 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.54 0.589 0 CA-C-O 121.809 0.814 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.2 m -134.05 71.36 1.45 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.662 1.985 . . . . 0.0 111.3 -173.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 66.44 8.76 5.97 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 163.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -128.44 -32.6 2.18 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.27 1.028 . . . . 0.0 111.903 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -76.1 -42.71 46.33 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.978 1.311 . . . . 0.0 111.407 -170.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.25 -31.02 72.06 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.179 0.992 . . . . 0.0 112.846 166.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -68.21 -3.48 10.8 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 169.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -103.54 -55.96 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.287 1.435 . . . . 0.0 109.579 166.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.8 t -74.18 -50.69 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 CA-C-N 119.308 0.958 . . . . 0.0 113.075 -170.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.09 -34.72 78.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.88 0.764 . . . . 0.0 111.084 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.05 -35.52 77.15 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 170.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.51 -39.72 70.6 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.182 -0.949 . . . . 0.0 111.521 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -36.82 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 O-C-N 120.601 -1.312 . . . . 0.0 110.944 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.8 m -70.83 -11.49 60.99 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 171.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -104.48 -42.24 5.5 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.318 1.417 . . . . 0.0 112.873 -172.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.9 m -128.81 -13.36 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.49 -79.2 0.34 Allowed Glycine 0 N--CA 1.47 0.923 0 C-N-CA 125.075 1.322 . . . . 0.0 112.504 164.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 tp -159.8 -47.33 0.05 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.371 1.068 . . . . 0.0 112.143 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -106.34 -13.39 15.39 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.684 1.594 . . . . 0.0 114.307 -170.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -87.16 -11.04 51.15 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -171.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.4 pp -69.9 175.1 4.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.166 1.786 . . . . 0.0 113.975 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -117.68 120.85 39.26 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.083 0.953 . . . . 0.0 111.964 -178.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.11 -24.91 68.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.289 0.636 . . . . 0.0 112.641 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.0 m -69.38 -43.6 73.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.9 1.28 . . . . 0.0 112.1 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -63.51 -38.51 91.4 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.266 -1.521 . . . . 0.0 111.763 173.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.73 -51.29 69.98 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.775 0.43 . . . . 0.0 111.633 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 98.6 p -65.26 -26.8 68.25 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -74.17 -46.44 42.23 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.608 1.563 . . . . 0.0 112.07 175.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.3 mmt-85 -72.8 -42.9 63.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.846 1.258 . . . . 0.0 113.127 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -92.38 -20.34 21.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.102 1.761 . . . . 0.0 112.249 -170.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 62.25 68.17 0.69 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.279 1.832 . . . . 0.0 112.844 -178.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.5 pt -132.35 173.97 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 128.55 2.74 . . . . 0.0 108.527 174.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.7 t -78.36 152.94 32.04 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 121.126 -0.983 . . . . 0.0 110.573 165.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.6 t -57.49 -36.45 53.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.093 0.957 . . . . 0.0 111.134 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.46 -33.8 75.87 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -69.2 -33.45 73.37 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.049 -0.976 . . . . 0.0 111.396 172.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -49.67 54.26 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.548 1.067 . . . . 0.0 110.679 174.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -55.15 -39.23 69.25 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.439 1.496 . . . . 0.0 112.796 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.6 t -83.88 -41.16 17.73 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -59.93 -34.32 73.08 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 120.862 -1.149 . . . . 0.0 112.835 -179.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.09 -64.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.657 1.183 . . . . 0.0 110.408 171.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.71 -21.98 60.96 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -179.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 CA--C 1.541 0.613 0 CA-C-N 119.081 0.855 . . . . 0.0 112.725 -178.934 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.3 p . . . . . 0 N--CA 1.483 1.185 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 48.94 25.98 1.21 Allowed 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 125.83 1.652 . . . . 0.0 114.77 -166.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.52 -8.81 28.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.493 1.517 . . . . 0.0 113.805 -178.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -70.9 15.36 0.11 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.367 2.267 . . . . 0.0 115.569 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -77.39 1.87 17.69 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 126.703 2.001 . . . . 0.0 114.756 -172.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.4 m -147.6 -48.89 0.17 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.707 2.003 . . . . 0.0 110.297 -170.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.7 mt -71.31 156.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.649 1.18 . . . . 0.0 109.533 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? 68.23 -4.92 0.97 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.991 2.116 . . . . 0.0 116.118 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.7 mtm -102.99 -43.09 5.61 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -94.11 -9.07 37.74 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 . . . . . 0 CA--C 1.541 0.625 0 C-N-CA 125.325 1.45 . . . . 0.0 112.222 -175.893 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 CA--C 1.535 0.37 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.5 m -120.46 -66.76 1.03 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.802 1.641 . . . . 0.0 112.162 177.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -163.6 -48.91 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.0 110.453 -170.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.61 72.89 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.937 177.514 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -68.92 -34.42 75.36 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.185 0.994 . . . . 0.0 111.921 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -69.63 -33.62 72.9 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.88 -1.138 . . . . 0.0 111.847 171.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -67.09 -1.16 3.9 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 170.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.1 mt -112.53 -26.86 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.523 1.929 . . . . 0.0 112.44 171.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.2 t -107.95 -59.91 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.749 1.159 . . . . 0.0 112.378 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.37 93.81 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.767 0.827 . . . . 0.0 111.701 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -66.47 -38.44 87.33 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -71.38 -32.05 68.01 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.619 1.168 . . . . 0.0 112.677 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.56 -31.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.08 0.952 . . . . 0.0 111.768 167.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 t -74.71 -17.16 60.7 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.479 0.712 . . . . 0.0 112.86 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -90.61 -44.21 9.68 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.223 -0.923 . . . . 0.0 111.318 176.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 84.9 t -108.12 -48.85 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -167.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.34 -79.84 0.18 Allowed Glycine 0 N--CA 1.469 0.894 0 CA-C-N 118.182 0.446 . . . . 0.0 114.053 170.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 tt -172.63 -39.3 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.805 1.642 . . . . 0.0 113.331 -173.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -121.62 -9.69 8.89 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.616 1.567 . . . . 0.0 114.984 -168.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -3.29 28.09 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -172.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.38 157.43 37.06 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.59 1.956 . . . . 0.0 113.961 -170.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -85.38 104.93 15.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.214 1.006 . . . . 0.0 109.726 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.78 -24.39 61.72 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.347 0.659 . . . . 0.0 112.349 171.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -58.67 -46.03 88.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.426 1.89 . . . . 0.0 112.405 169.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -63.63 -37.64 88.11 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.307 -1.495 . . . . 0.0 112.423 175.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.19 -49.82 70.53 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.566 0.621 . . . . 0.0 112.174 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.1 p -64.53 -22.96 67.11 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.235 -0.916 . . . . 0.0 113.468 -179.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -81.76 -14.47 56.41 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.608 1.563 . . . . 0.0 113.751 175.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -119.99 -42.18 2.61 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.227 1.411 . . . . 0.0 113.582 -172.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.1 mp -85.85 -12.01 51.88 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.868 1.267 . . . . 0.0 112.603 172.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.67 63.97 1.55 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.313 1.445 . . . . 0.0 111.905 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -128.22 167.19 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 126.937 2.095 . . . . 0.0 111.45 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.8 m -63.86 141.46 58.76 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.72 1.208 . . . . 0.0 109.721 167.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.74 -36.94 68.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.251 -0.905 . . . . 0.0 111.437 -178.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -72.83 -28.71 62.71 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 177.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -66.05 -40.07 90.63 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.524 -0.75 . . . . 0.0 110.519 168.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.75 -47.82 73.95 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.91 0.777 . . . . 0.0 111.14 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.51 -38.69 69.53 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.451 1.5 . . . . 0.0 112.942 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -88.76 -34.95 16.94 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.96 -34.91 79.05 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.73 1.212 . . . . 0.0 112.884 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.6 mt -50.29 -36.36 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.735 1.214 . . . . 0.0 112.096 173.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -92.01 -43.95 9.14 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.969 0.908 . . . . 0.0 112.799 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 . . . . . 0 CA--C 1.545 0.764 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -172.494 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 56.5 7.92 0.4 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 126.72 2.008 . . . . 0.0 115.543 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -12.44 59.99 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 119.992 -1.692 . . . . 0.0 113.906 -173.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -72.61 13.15 0.39 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 127.085 2.154 . . . . 0.0 114.835 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -91.32 -4.3 55.96 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.727 2.411 . . . . 0.0 114.64 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 63.6 m -138.61 -49.36 0.53 Allowed 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.994 1.718 . . . . 0.0 110.343 -172.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 44.1 pt -70.44 164.67 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.49 1.116 . . . . 0.0 111.873 176.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 65.14 -9.54 0.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 127.263 2.225 . . . . 0.0 116.346 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 46.0 mtm -93.29 -39.49 10.94 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.781 1.173 . . . . 0.0 113.945 -175.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -120.69 0.84 10.49 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -173.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 CA--C 1.541 0.617 0 C-N-CA 124.477 1.111 . . . . 0.0 111.149 -175.849 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp . . . . . 0 C--O 1.233 0.217 0 CA-C-O 122.021 0.915 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.5 t -92.06 -69.79 0.72 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.312 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -161.8 -29.95 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.64 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -99.39 0.07 41.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.996 1.318 . . . . 0.0 112.311 177.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -106.39 -37.11 6.61 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.189 0.904 . . . . 0.0 112.87 175.603 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -65.15 -29.41 70.24 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.776 -1.202 . . . . 0.0 112.515 174.331 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -65.66 -6.38 11.16 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.829 1.252 . . . . 0.0 114.147 170.263 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.0 mp -104.89 -55.81 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 125.52 1.528 . . . . 0.0 110.116 167.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.9 t -65.05 -55.93 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 119.435 1.016 . . . . 0.0 111.613 -172.324 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.96 65.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -175.397 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -34.4 73.8 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.645 -0.659 . . . . 0.0 112.572 166.849 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.72 -37.95 70.57 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.25 0.932 . . . . 0.0 111.796 172.711 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -60.16 -31.16 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 120.491 -1.381 . . . . 0.0 110.899 173.053 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 t -74.28 -13.17 60.73 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 171.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -102.05 -43.98 5.6 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.529 -1.357 . . . . 0.0 112.959 -167.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.06 -11.7 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -169.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 135.47 -86.44 0.25 Allowed Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.767 1.175 . . . . 0.0 111.462 170.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -162.56 -44.74 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.599 1.56 . . . . 0.0 111.109 176.598 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -104.24 -13.44 16.18 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.516 1.526 . . . . 0.0 114.596 -168.591 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -85.99 -16.28 38.82 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -66.33 159.78 26.03 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.981 1.312 . . . . 0.0 113.815 179.12 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -104.23 117.97 35.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.225 1.01 . . . . 0.0 110.747 178.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.56 -24.4 66.62 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.519 1.127 . . . . 0.0 113.63 178.84 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.6 m -68.22 -40.72 81.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.041 0.936 . . . . 0.0 111.769 173.638 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -68.01 -29.19 68.13 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.353 -1.467 . . . . 0.0 113.007 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.64 -57.71 7.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.932 0.893 . . . . 0.0 111.345 165.616 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.0 p -60.44 -24.64 65.36 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.38 1.072 . . . . 0.0 113.657 -174.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -67.98 -24.51 65.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.496 1.918 . . . . 0.0 114.257 173.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 mtm-85 -112.65 -37.08 5.01 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.818 1.647 . . . . 0.0 113.411 -179.672 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -73.8 -17.83 61.03 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.108 0.963 . . . . 0.0 112.45 171.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 57.69 49.9 11.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.64 1.576 . . . . 0.0 111.626 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.0 pt -113.98 175.37 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 127.254 2.222 . . . . 0.0 110.952 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.4 m -71.96 137.57 47.41 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.726 1.61 . . . . 0.0 108.854 165.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.5 t -57.04 -40.13 70.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 O-C-N 121.782 -0.574 . . . . 0.0 111.139 -178.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.18 -26.95 63.19 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.335 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -68.23 -39.33 82.34 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.739 168.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.05 -49.09 73.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.461 1.028 . . . . 0.0 110.433 175.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -54.55 -41.42 69.76 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.492 1.517 . . . . 0.0 112.866 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -87.08 -33.32 19.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 177.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -61.91 -38.94 90.26 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.072 -1.017 . . . . 0.0 112.508 178.072 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.7 mt -46.86 -58.04 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.093 1.357 . . . . 0.0 110.358 173.581 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -72.89 -33.21 65.9 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.413 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 . . . . . 0 N--CA 1.471 0.594 0 CA-C-N 119.202 0.91 . . . . 0.0 113.181 -178.704 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.8 p . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 48.55 27.31 1.42 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.317 1.847 . . . . 0.0 114.388 -168.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.8 -10.33 24.97 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.738 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -70.72 10.72 0.46 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.197 2.199 . . . . 0.0 116.38 -169.302 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -87.1 -9.56 55.04 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.322 1.849 . . . . 0.0 114.817 -169.897 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.1 m -140.56 -44.09 0.4 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.778 1.631 . . . . 0.0 110.61 -165.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.0 pt -62.59 169.4 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 124.402 1.081 . . . . 0.0 111.697 169.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt 69.13 -19.99 0.17 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.574 1.949 . . . . 0.0 115.95 176.293 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 17.1 ptp -124.44 6.99 8.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.437 1.495 . . . . 0.0 113.79 -175.699 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -146.89 -30.51 0.35 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.27 1.428 . . . . 0.0 113.331 -167.588 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 126.148 1.779 . . . . 0.0 112.41 -179.837 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 C--O 1.234 0.244 0 CA-C-O 121.894 0.854 . . . . 0.0 110.46 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -104.74 -75.07 0.63 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.894 1.678 . . . . 0.0 111.648 -178.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -158.83 -40.65 0.06 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.61 -31.5 71.57 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 122.178 -0.326 . . . . 0.0 110.897 172.348 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -71.01 -44.81 65.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.644 0.778 . . . . 0.0 112.004 -171.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt -71.41 -22.54 61.85 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.54 -1.35 . . . . 0.0 112.977 175.625 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -70.87 1.48 5.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.997 1.319 . . . . 0.0 113.973 164.814 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 mt -115.31 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.136 1.774 . . . . 0.0 110.319 168.652 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.26 -62.3 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.047 1.294 . . . . 0.0 112.069 -178.613 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.36 -33.19 74.7 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.646 -0.659 . . . . 0.0 110.991 -177.183 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.29 -23.3 65.59 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 169.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.67 -40.73 17.06 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.461 1.028 . . . . 0.0 111.216 172.738 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.61 -35.44 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.995 -1.065 . . . . 0.0 111.499 176.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.8 p -76.8 -5.21 47.32 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 174.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -98.76 -54.17 3.08 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.331 1.423 . . . . 0.0 112.055 177.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -115.58 -16.36 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -166.109 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.65 -78.88 0.36 Allowed Glycine 0 N--CA 1.467 0.717 0 C-N-CA 125.494 1.521 . . . . 0.0 111.579 167.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -165.94 -45.24 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.842 1.257 . . . . 0.0 112.141 174.148 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -97.33 -14.9 21.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.208 1.803 . . . . 0.0 114.381 -172.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -87.68 -15.62 36.65 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -171.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -67.69 165.35 17.37 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.914 1.285 . . . . 0.0 112.115 165.023 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.6 p30 -119.35 169.46 9.98 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.466 1.127 . . . . 0.0 112.043 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.2 -26.5 39.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.667 1.187 . . . . 0.0 112.819 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -63.71 -51.58 64.38 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.953 1.301 . . . . 0.0 111.275 -179.161 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -62.89 -39.03 93.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.528 0.731 . . . . 0.0 111.587 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.33 -46.03 90.52 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.294 0.637 . . . . 0.0 111.608 174.289 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.4 p -62.04 -25.81 67.89 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.984 -1.073 . . . . 0.0 113.685 177.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -84.27 -39.05 19.72 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.487 1.515 . . . . 0.0 112.021 -177.187 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -91.16 -38.68 12.58 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.259 1.024 . . . . 0.0 113.348 -179.762 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.01 -19.88 42.99 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.561 1.144 . . . . 0.0 113.072 177.976 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 61.76 69.33 0.65 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.876 1.67 . . . . 0.0 112.143 -177.49 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.5 pt -137.42 168.39 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 126.734 2.013 . . . . 0.0 111.467 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.7 m -60.81 139.21 58.01 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.413 1.485 . . . . 0.0 110.147 162.496 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -61.12 -35.29 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.28 -0.887 . . . . 0.0 111.511 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.79 -30.01 66.36 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.095 -1.003 . . . . 0.0 113.377 177.551 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.47 -40.05 94.96 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.82 167.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.07 -48.42 73.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.194 0.906 . . . . 0.0 110.962 177.254 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -56.1 -40.84 74.29 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.797 1.239 . . . . 0.0 112.476 179.474 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -88.4 -33.68 17.81 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.19 -38.31 90.69 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.237 1.015 . . . . 0.0 112.359 177.48 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.5 mt -48.92 -52.54 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.216 1.006 . . . . 0.0 110.651 175.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -80.85 -32.33 35.09 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 . . . . . 0 CA--C 1.541 0.634 0 CA-C-N 119.882 1.219 . . . . 0.0 113.179 -179.024 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.8 m120 48.45 32.36 3.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.887 1.675 . . . . 0.0 113.436 -167.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.29 -5.38 19.17 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.254 1.422 . . . . 0.0 114.478 -179.464 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -75.45 13.82 0.7 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.512 1.925 . . . . 0.0 115.526 -168.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -91.47 11.85 22.65 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.685 1.994 . . . . 0.0 113.752 -163.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.6 m -150.94 -47.84 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.658 2.783 . . . . 0.0 108.604 -169.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -73.99 156.08 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.224 1.01 . . . . 0.0 109.454 179.371 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.47 -7.11 0.57 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 127.411 2.284 . . . . 0.0 116.438 -178.683 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 37.2 mtm -96.91 -50.59 4.58 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.946 1.248 . . . . 0.0 113.678 -174.705 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -91.41 -7.67 50.05 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -176.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 . . . . . 0 N--CA 1.474 0.757 0 C-N-CA 125.221 1.408 . . . . 0.0 114.247 -168.699 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -82.73 -71.37 0.5 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.996 0.918 . . . . 0.0 112.726 -175.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -163.57 -35.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.101 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -29.22 47.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.74 0.416 . . . . 0.0 111.095 170.906 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -77.62 -42.64 34.21 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.569 1.548 . . . . 0.0 112.045 -168.576 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -68.73 -26.14 65.11 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.228 -0.92 . . . . 0.0 113.035 173.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -68.9 -1.09 6.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.164 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 mt -113.86 -45.23 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.414 1.486 . . . . 0.0 110.209 172.078 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 36.4 t -73.55 -64.16 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 CA-C-N 119.459 1.027 . . . . 0.0 112.01 179.07 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.01 -27.42 65.66 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.786 -0.571 . . . . 0.0 112.377 -174.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.67 -42.36 78.89 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 165.699 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -36.45 81.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.905 0.882 . . . . 0.0 111.736 175.557 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.4 mm -62.84 -22.11 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 120.861 -1.149 . . . . 0.0 111.429 175.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 t -83.79 -11.16 57.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 171.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -96.93 -60.03 1.68 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.522 -1.361 . . . . 0.0 112.099 -175.835 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -113.46 -17.47 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 N-CA-C 114.922 1.452 . . . . 0.0 114.922 -164.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.47 -83.87 0.26 Allowed Glycine 0 N--CA 1.465 0.632 0 C-N-CA 125.349 1.452 . . . . 0.0 111.171 167.615 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -161.3 -46.7 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.58 1.152 . . . . 0.0 112.333 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -96.97 -20.31 18.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.189 1.796 . . . . 0.0 114.472 -174.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -84.65 -11.26 56.29 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -167.627 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.31 163.03 23.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.178 1.791 . . . . 0.0 114.417 176.4 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -87.75 -172.41 3.85 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.77 1.628 . . . . 0.0 109.991 174.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -120.82 -19.22 7.4 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.038 1.335 . . . . 0.0 112.964 167.379 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.9 m -72.26 -53.41 12.57 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.401 1.08 . . . . 0.0 112.286 -173.415 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.2 -25.03 65.02 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 120.75 -1.219 . . . . 0.0 113.673 179.764 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.28 -58.89 4.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.517 0.727 . . . . 0.0 111.101 166.566 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.5 p -61.1 -25.62 67.09 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -177.121 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -69.06 -41.16 77.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.567 1.547 . . . . 0.0 113.082 171.569 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -89.73 -37.95 14.19 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.272 1.429 . . . . 0.0 112.879 -174.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -20.33 57.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.103 1.361 . . . . 0.0 113.172 171.028 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.21 58.91 2.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.833 1.253 . . . . 0.0 111.398 -177.717 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.0 pt -123.25 174.47 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 127.069 2.147 . . . . 0.0 110.185 174.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 51.7 m -70.36 141.29 52.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.643 1.577 . . . . 0.0 109.515 166.783 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.3 t -58.58 -39.39 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 O-C-N 121.426 -0.796 . . . . 0.0 111.057 179.442 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -70.52 -28.5 64.99 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -66.34 -39.52 89.28 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.125 -0.941 . . . . 0.0 110.786 168.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.65 72.22 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.251 0.932 . . . . 0.0 110.544 176.208 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -54.87 -37.73 66.63 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.088 1.355 . . . . 0.0 113.044 -179.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -86.51 -41.23 14.52 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 118.792 0.724 . . . . 0.0 112.732 174.695 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -61.33 -34.78 75.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.067 -1.02 . . . . 0.0 113.066 -177.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.0 mt -46.66 -62.75 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.134 1.374 . . . . 0.0 110.027 171.38 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -76.32 -19.11 58.56 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -179.417 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 . . . . . 0 CA--C 1.544 0.744 0 CA-C-N 118.832 0.742 . . . . 0.0 112.502 177.222 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.3 m120 53.9 26.39 6.19 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.252 1.821 . . . . 0.0 115.049 -174.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -8.61 40.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.495 1.118 . . . . 0.0 113.917 -178.514 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 p90 -70.37 7.31 1.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.931 2.092 . . . . 0.0 116.619 -168.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 -4.62 59.21 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.448 1.499 . . . . 0.0 114.796 -169.8 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.5 m -141.88 -46.53 0.36 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.02 1.728 . . . . 0.0 109.93 -167.147 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.6 169.8 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 123.637 0.775 . . . . 0.0 111.329 173.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 69.06 -14.29 0.31 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.051 2.14 . . . . 0.0 115.5 -174.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 13.43 2.2 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 178.339 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -146.54 38.14 1.02 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.226 1.01 . . . . 0.0 112.904 -173.334 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 . . . . . 0 CA--C 1.543 0.683 0 C-N-CA 124.792 1.237 . . . . 0.0 112.975 -168.05 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 121.636 0.731 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.6 p -126.46 -69.64 0.76 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.667 1.587 . . . . 0.0 112.378 174.786 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.89 -34.31 0.05 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -167.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -76.83 -13.98 59.95 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.568 0.747 . . . . 0.0 111.278 172.347 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 mp0 -86.87 -43.65 12.29 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.097 0.862 . . . . 0.0 112.719 -177.304 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.32 -32.9 74.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.153 -0.967 . . . . 0.0 112.367 178.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -64.5 -2.79 2.52 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 115.548 1.685 . . . . 0.0 115.548 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.8 mt -112.12 -17.4 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.734 1.613 . . . . 0.0 112.276 174.443 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 17.9 t -127.68 -53.14 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.187 0.903 . . . . 0.0 113.373 -172.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.82 -37.89 88.54 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.778 1.172 . . . . 0.0 110.845 171.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.95 -28.3 69.43 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.992 0.917 . . . . 0.0 113.054 170.749 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -37.84 59.24 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.307 1.043 . . . . 0.0 111.59 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.5 -33.78 55.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.937 -1.102 . . . . 0.0 110.773 170.327 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -72.57 -10.31 59.64 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 169.67 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -107.53 -42.72 4.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.499 1.499 . . . . 0.0 112.987 -172.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.0 m -127.99 -13.19 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -173.082 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -83.35 0.3 Allowed Glycine 0 N--CA 1.469 0.89 0 C-N-CA 124.931 1.253 . . . . 0.0 112.223 169.092 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.8 tt -167.85 -44.5 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.123 1.769 . . . . 0.0 111.01 -177.504 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -107.44 -10.57 15.71 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.174 1.79 . . . . 0.0 114.913 -168.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -89.2 -20.34 24.31 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -176.39 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.15 162.82 23.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.638 1.175 . . . . 0.0 112.116 166.48 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -120.73 174.24 6.71 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.526 1.155 . . . . 0.0 112.007 174.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.1 -23.95 35.43 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.906 1.282 . . . . 0.0 112.995 179.355 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.7 m -63.36 -51.4 66.09 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.252 1.421 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -64.33 -39.07 93.16 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.41 -0.806 . . . . 0.0 112.183 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.33 -51.03 71.5 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 168.537 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.5 p -60.14 -24.86 65.03 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.686 -1.259 . . . . 0.0 113.831 -178.529 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -87.15 -47.93 8.48 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.177 1.791 . . . . 0.0 111.922 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -90.24 -29.53 18.13 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.368 1.067 . . . . 0.0 113.39 -174.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.2 tp -93.99 -14.57 25.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.759 1.624 . . . . 0.0 112.785 178.623 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.16 66.59 0.94 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.307 1.843 . . . . 0.0 112.644 175.569 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 pt -142.94 167.56 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 127.263 2.225 . . . . 0.0 111.078 -179.059 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 7.4 m -53.93 139.55 33.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.581 1.552 . . . . 0.0 110.813 164.487 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 t -58.31 -38.54 69.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 121.602 -0.686 . . . . 0.0 111.149 175.326 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -72.9 -28.67 62.62 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.132 -0.98 . . . . 0.0 113.356 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -66.57 -37.43 84.92 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.498 -0.763 . . . . 0.0 110.937 168.139 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.12 -47.49 73.96 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.843 0.747 . . . . 0.0 110.555 174.954 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -57.28 -38.85 74.57 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.24 1.016 . . . . 0.0 112.738 -179.544 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -89.6 -31.64 17.48 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -63.65 -38.04 89.61 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 120.585 -1.322 . . . . 0.0 112.138 176.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.9 mt -49.66 -56.67 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.143 0.977 . . . . 0.0 110.545 174.648 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -70.93 -35.76 72.37 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 179.106 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 . . . . . 0 N--CA 1.474 0.727 0 CA-C-N 119.348 0.976 . . . . 0.0 112.965 178.91 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 121.814 0.816 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.89 25.14 15.11 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.922 2.089 . . . . 0.0 113.426 165.16 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -87.96 -10.05 51.68 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.414 1.485 . . . . 0.0 113.449 -173.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -76.05 15.47 0.55 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.679 2.392 . . . . 0.0 114.59 -176.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 32.4 pttt -83.34 -6.71 59.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.22 2.608 . . . . 0.0 114.191 -171.14 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 44.3 m -143.16 -54.54 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 126.586 1.955 . . . . 0.0 109.806 -172.486 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.5 pt -71.98 164.74 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.038 0.935 . . . . 0.0 111.91 177.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 -4.41 0.48 Allowed 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -178.617 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 44.3 mtm -97.83 -49.49 4.79 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.764 1.166 . . . . 0.0 113.627 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -107.26 -7.29 16.8 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -175.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.54 0.586 0 C-N-CA 125.127 1.371 . . . . 0.0 111.568 -174.1 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 CA--C 1.535 0.374 0 CA-C-O 121.536 0.684 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.6 m -116.7 -70.21 0.81 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.308 1.843 . . . . 0.0 112.68 -175.182 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -161.82 -41.21 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -171.682 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.1 -27.6 61.8 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.627 . . . . 0.0 110.866 174.198 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -72.91 -33.93 66.29 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.872 1.269 . . . . 0.0 110.803 -176.087 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -70.21 -34.5 72.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.879 0.871 . . . . 0.0 112.296 170.509 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -65.46 -3.73 4.77 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 171.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 mt -107.85 -53.89 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.772 1.629 . . . . 0.0 110.124 167.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.21 -62.85 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 124.194 0.998 . . . . 0.0 112.148 -174.431 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.93 66.88 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.593 0.757 . . . . 0.0 111.903 -177.113 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.12 -44.8 83.65 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.792 0.437 . . . . 0.0 111.945 164.738 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.03 -38.11 89.87 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.343 1.057 . . . . 0.0 112.47 174.806 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -62.6 -19.4 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.941 0.897 . . . . 0.0 111.632 176.182 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -88.18 -13.07 42.08 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.98 1.312 . . . . 0.0 114.26 172.305 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -96.82 -55.57 2.84 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.544 -1.348 . . . . 0.0 112.207 -175.14 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.9 m -118.64 -18.11 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -167.551 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.23 -85.79 0.32 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 125.775 1.655 . . . . 0.0 111.049 169.664 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.5 tp -167.04 -36.6 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.947 1.299 . . . . 0.0 112.919 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -104.53 -9.43 18.34 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.01 1.324 . . . . 0.0 114.035 -173.996 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -97.23 -14.74 21.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.568 1.147 . . . . 0.0 113.412 -175.82 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -70.59 164.33 25.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.071 1.348 . . . . 0.0 111.942 170.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -121.9 167.72 12.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.294 1.045 . . . . 0.0 112.114 174.182 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.08 -25.52 43.07 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.397 1.079 . . . . 0.0 112.668 -178.421 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.7 m -64.41 -45.49 87.35 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.67 1.588 . . . . 0.0 112.208 -179.113 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -65.52 -36.93 85.27 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.611 -1.305 . . . . 0.0 112.231 176.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.27 -49.24 72.62 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.4 0.68 . . . . 0.0 111.818 172.35 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.3 p -64.98 -25.69 67.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.046 0.938 . . . . 0.0 113.312 -179.083 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -76.11 -35.61 59.22 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.159 1.384 . . . . 0.0 112.712 177.11 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.6 mmm-85 -100.13 -32.77 10.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.981 1.312 . . . . 0.0 113.452 -172.397 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.3 mt -86.8 -19.31 29.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.103 1.361 . . . . 0.0 112.829 173.194 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.63 57.73 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.277 1.431 . . . . 0.0 112.072 -176.09 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.8 pt -120.28 167.4 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 127.747 2.419 . . . . 0.0 109.928 175.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.2 t -70.91 151.42 44.73 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.392 -0.817 . . . . 0.0 110.747 165.679 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.79 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.006 0.922 . . . . 0.0 111.262 -177.41 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -67.46 -32.63 73.62 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 179.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.77 -35.29 76.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.206 171.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.25 -47.39 67.9 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.809 0.731 . . . . 0.0 110.636 175.726 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -57.04 -41.96 79.62 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.231 1.412 . . . . 0.0 112.831 179.249 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 t -83.86 -34.08 24.68 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.173 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -65.71 -36.19 82.9 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.972 -1.08 . . . . 0.0 112.32 176.899 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.7 mt -51.13 -60.44 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.098 0.959 . . . . 0.0 109.841 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -54.14 -26.9 30.14 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 127.472 2.309 . . . . 0.0 115.802 174.422 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 . . . . . 0 CA--C 1.545 0.776 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 176.774 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 65.54 37.13 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 128.038 2.535 . . . . 0.0 111.868 166.002 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -78.29 -19.43 53.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.398 1.879 . . . . 0.0 114.942 -177.694 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -110.95 20.34 17.6 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.787 1.235 . . . . 0.0 112.78 -150.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -86.66 9.05 19.88 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 128.211 2.605 . . . . 0.0 114.721 -173.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.9 m -146.38 -49.32 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.439 1.895 . . . . 0.0 109.699 -169.327 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -80.86 155.38 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.411 1.485 . . . . 0.0 109.417 179.483 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? 64.04 14.19 8.3 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 126.011 1.724 . . . . 0.0 115.316 -178.6 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 20.9 mtm -115.48 -21.34 9.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 -178.048 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -129.27 -6.1 4.84 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -174.98 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 125.218 1.407 . . . . 0.0 113.018 -174.142 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 121.494 0.664 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 62.6 m -115.88 -68.98 0.88 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.162 1.785 . . . . 0.0 112.27 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -163.82 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 123.452 0.701 . . . . 0.0 111.443 -171.004 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -68.56 -28.83 67.31 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.547 1.139 . . . . 0.0 110.264 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -72.81 -34.89 67.16 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.475 1.11 . . . . 0.0 112.062 178.667 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -70.4 -34.98 73.16 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.848 -1.158 . . . . 0.0 112.491 173.085 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -60.89 -6.32 1.76 Allowed 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 168.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.3 mt -108.13 -56.79 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.84 1.656 . . . . 0.0 110.342 169.419 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.1 t -69.18 -61.79 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 123.856 0.862 . . . . 0.0 111.373 -173.599 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.38 70.56 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.358 0.663 . . . . 0.0 111.829 -177.097 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.06 -44.61 87.56 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 122.889 0.475 . . . . 0.0 112.197 167.681 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -36.75 80.92 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.992 0.917 . . . . 0.0 112.257 175.329 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.1 mm -60.56 -28.32 42.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.772 -1.205 . . . . 0.0 110.655 175.664 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -77.14 -14.75 59.74 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 173.074 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -93.74 -54.28 3.69 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.398 -1.439 . . . . 0.0 112.115 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.3 m -118.63 -13.17 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -164.709 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.7 -77.31 0.4 Allowed Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.365 1.46 . . . . 0.0 112.106 166.438 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.9 tp -163.66 -43.5 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.321 1.449 . . . . 0.0 111.854 170.758 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -108.96 -5.6 16.03 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -167.606 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -89.7 -17.71 27.82 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.037 0.935 . . . . 0.0 112.993 -176.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.36 164.46 9.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.802 1.241 . . . . 0.0 112.528 165.863 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -110.36 167.01 10.52 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 122.292 1.044 . . . . 0.0 111.466 171.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.04 -24.25 37.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.145 0.978 . . . . 0.0 112.412 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.39 -45.25 93.96 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.192 1.797 . . . . 0.0 112.519 -179.49 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -65.26 -41.82 93.88 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.639 -1.288 . . . . 0.0 111.989 176.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.52 -46.06 90.13 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.657 -0.652 . . . . 0.0 111.912 174.235 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.7 p -65.37 -23.47 66.98 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.182 -0.949 . . . . 0.0 113.402 179.366 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.03 1.332 . . . . 0.0 112.389 176.253 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -102.74 -40.22 6.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.363 1.465 . . . . 0.0 113.072 -169.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.4 mp -81.03 -17.77 49.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.606 1.162 . . . . 0.0 113.207 170.304 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.92 58.24 2.83 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-O 122.693 1.235 . . . . 0.0 111.49 -175.282 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.1 pt -122.79 164.56 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 128.011 2.524 . . . . 0.0 109.532 177.024 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 t -70.64 153.49 42.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 121.243 -0.91 . . . . 0.0 110.766 167.568 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -58.3 -37.69 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.869 0.868 . . . . 0.0 111.167 -177.366 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.62 -29.99 68.62 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 179.396 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -67.3 -38.36 84.85 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.096 170.338 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.66 -48.12 67.56 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.632 0.651 . . . . 0.0 110.329 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -56.47 -32.41 64.94 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.95 1.7 . . . . 0.0 113.987 178.751 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -90.25 -42.05 11.22 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.968 0.804 . . . . 0.0 112.822 173.454 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.6 -35.77 72.96 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.899 -1.126 . . . . 0.0 113.333 -178.393 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.6 mt -50.37 -42.47 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 0.0 112.25 174.231 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -94.59 -25.76 16.66 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 176.396 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 . . . . . 0 CA--C 1.543 0.687 0 CA-C-N 118.819 0.736 . . . . 0.0 112.952 -179.724 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 41.1 p . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 123.247 1.499 . . . . 0.0 113.332 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -84.58 -8.0 59.06 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.457 2.303 . . . . 0.0 112.002 -173.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.4 -17.59 59.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 128.389 2.676 . . . . 0.0 113.163 176.666 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -71.52 15.69 0.13 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.015 2.126 . . . . 0.0 115.81 -174.709 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -66.82 100.12 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.318 -1.489 . . . . 0.0 109.573 -176.085 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 75.79 2.58 3.72 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.385 2.674 . . . . 0.0 114.827 -176.623 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.2 mt -117.66 145.72 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.898 1.279 . . . . 0.0 109.993 -175.464 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 60.52 14.27 4.75 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.643 1.577 . . . . 0.0 114.344 -169.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.7 ptm -138.01 9.69 2.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.984 1.713 . . . . 0.0 114.02 -178.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -145.69 -36.05 0.29 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.03 1.492 . . . . 0.0 115.03 -163.099 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 . . . . . 0 N--CA 1.474 0.738 0 O-C-N 121.355 -0.84 . . . . 0.0 112.9 -175.266 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.424 0.63 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -93.08 -78.41 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 125.489 1.516 . . . . 0.0 111.188 170.231 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -156.56 -46.13 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 122.971 0.508 . . . . 0.0 111.156 -172.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -65.83 -29.72 70.23 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.438 0.695 . . . . 0.0 111.683 175.542 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -73.63 -45.9 50.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.954 0.901 . . . . 0.0 111.866 -169.273 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -67.12 -28.14 67.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.221 1.009 . . . . 0.0 112.63 169.926 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -69.74 -1.74 10.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.803 1.241 . . . . 0.0 114.087 170.045 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -106.54 -53.76 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.149 1.38 . . . . 0.0 109.932 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.5 t -72.39 -59.15 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.092 0.86 . . . . 0.0 112.066 -174.694 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.87 64.48 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.495 0.589 . . . . 0.0 112.294 -177.41 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.18 -44.56 94.96 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.661 -0.65 . . . . 0.0 112.392 164.633 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.93 -34.31 77.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.053 0.842 . . . . 0.0 111.945 175.582 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -61.52 -22.66 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 O-C-N 120.559 -1.338 . . . . 0.0 112.023 174.154 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 t -83.63 -12.79 55.53 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.557 1.143 . . . . 0.0 114.065 171.952 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -93.41 -56.37 2.96 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.635 -1.291 . . . . 0.0 112.284 -175.607 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.3 m -122.94 -17.23 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 -165.611 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 130.45 -89.08 0.3 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 125.758 1.647 . . . . 0.0 110.413 172.711 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 54.3 tp -163.72 -36.33 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.101 1.36 . . . . 0.0 113.066 177.921 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -107.68 -2.66 19.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -173.287 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -94.91 -17.84 21.66 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.241 1.016 . . . . 0.0 112.955 178.771 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -73.43 164.41 26.7 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.336 1.454 . . . . 0.0 111.924 169.634 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.9 p30 -115.39 172.61 6.99 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.194 0.997 . . . . 0.0 111.653 170.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.79 -21.36 29.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.427 1.091 . . . . 0.0 112.611 178.571 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.0 m -63.25 -50.19 71.16 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.892 1.677 . . . . 0.0 111.643 -178.346 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -66.37 -45.53 79.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.829 -1.169 . . . . 0.0 112.276 -179.296 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -52.29 -54.31 32.96 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.504 1.122 . . . . 0.0 112.241 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.4 p -66.88 -27.99 67.96 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -177.599 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -70.8 -46.76 62.25 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.086 1.355 . . . . 0.0 112.637 173.324 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 66.1 mtt85 -78.46 -40.61 35.12 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.21 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -85.45 -19.01 31.92 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.395 1.478 . . . . 0.0 111.747 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.23 66.52 0.71 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.0 1.72 . . . . 0.0 111.92 179.069 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -132.37 172.75 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 127.004 2.121 . . . . 0.0 110.956 178.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 55.0 m -66.05 137.72 57.28 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.226 1.41 . . . . 0.0 109.05 165.625 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.7 t -57.41 -38.97 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 O-C-N 121.716 -0.615 . . . . 0.0 110.984 -179.131 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.87 -26.53 64.24 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.815 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -66.78 -39.49 87.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.566 -0.73 . . . . 0.0 111.268 169.526 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.53 -45.72 74.91 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.901 0.773 . . . . 0.0 110.299 175.031 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -54.79 -42.24 71.52 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.765 1.226 . . . . 0.0 112.608 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -83.4 -38.06 22.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 176.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.62 -33.75 75.63 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.067 -1.021 . . . . 0.0 113.277 -178.503 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -49.13 -47.0 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.988 1.315 . . . . 0.0 111.418 172.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -87.32 -26.88 23.17 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 175.694 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 . . . . . 0 CA--C 1.543 0.694 0 CA-C-N 119.192 0.906 . . . . 0.0 112.632 -179.29 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 72.3 p . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 57.3 40.56 27.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.739 1.615 . . . . 0.0 111.616 -171.676 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -82.05 -19.07 41.04 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.536 1.535 . . . . 0.0 114.865 -174.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -116.06 10.61 15.09 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -141.824 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -85.12 -6.53 59.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.354 1.862 . . . . 0.0 115.02 -167.53 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.1 m -144.45 -46.39 0.25 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.709 1.603 . . . . 0.0 110.993 -164.094 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.2 pt -75.93 174.37 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.044 1.338 . . . . 0.0 111.889 175.128 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 65.21 -15.69 0.1 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 127.18 2.192 . . . . 0.0 116.16 -175.039 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.0 ptm -123.85 1.13 8.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.708 1.603 . . . . 0.0 114.241 -176.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -134.2 -9.59 2.6 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -166.13 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 . . . . . 0 N--CA 1.472 0.635 0 C-N-CA 124.849 1.26 . . . . 0.0 110.813 -173.76 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 CA--C 1.535 0.385 0 CA-C-O 121.851 0.834 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.4 t -112.86 -77.22 0.58 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 127.42 2.288 . . . . 0.0 111.544 179.53 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -155.7 -40.98 0.08 Allowed 'General case' 0 C--N 1.327 -0.41 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -67.7 -28.76 67.95 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.546 0.739 . . . . 0.0 111.008 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.6 mp0 -71.84 -32.4 67.49 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.812 -0.555 . . . . 0.0 112.35 179.574 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mttt -70.08 -34.84 73.68 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 120.889 -1.132 . . . . 0.0 112.779 170.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -64.46 0.48 1.04 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 169.115 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -112.54 -52.2 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 126.531 1.932 . . . . 0.0 110.924 167.492 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 64.0 t -74.05 -59.97 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.905 0.775 . . . . 0.0 112.275 -175.061 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.05 -28.78 68.49 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.35 -11.32 40.92 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 167.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.04 -36.88 11.36 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.212 1.405 . . . . 0.0 111.299 167.132 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.7 mm -63.72 -27.55 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 O-C-N 120.518 -1.364 . . . . 0.0 112.027 178.915 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.0 p -68.43 -19.83 64.61 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 168.336 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -106.96 -42.06 5.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.173 0.897 . . . . 0.0 113.168 -157.526 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -128.03 -14.67 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.76 -93.33 0.29 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 125.821 1.677 . . . . 0.0 110.173 173.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -164.0 -28.78 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.636 1.574 . . . . 0.0 113.372 175.666 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -108.35 -12.91 14.98 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 114.603 -172.007 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -91.89 -20.18 21.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.121 0.968 . . . . 0.0 112.938 -175.857 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.0 pp -67.87 164.0 20.7 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.637 1.575 . . . . 0.0 112.187 166.62 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.06 171.25 7.78 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.374 1.083 . . . . 0.0 111.946 172.276 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -20.75 32.37 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.102 1.361 . . . . 0.0 113.005 -179.166 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.9 m -67.74 -46.99 70.55 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.835 1.654 . . . . 0.0 111.807 -178.564 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -65.8 -45.13 83.52 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.114 -0.991 . . . . 0.0 112.041 178.769 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -52.48 -56.34 15.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.085 0.554 . . . . 0.0 112.103 168.969 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.8 p -64.69 -21.84 66.84 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.235 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -74.03 -48.66 28.51 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.591 1.557 . . . . 0.0 112.187 173.377 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -76.11 -39.42 55.24 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.89 0.876 . . . . 0.0 112.636 179.762 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.3 mt -81.72 -21.99 37.61 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.094 1.357 . . . . 0.0 113.164 -179.125 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.65 58.5 2.85 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.335 1.454 . . . . 0.0 111.991 -176.764 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.4 pt -123.71 178.44 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 127.68 2.392 . . . . 0.0 109.644 175.358 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -76.59 147.88 37.34 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.494 -0.754 . . . . 0.0 110.843 164.438 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.2 t -53.76 -35.13 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.109 1.363 . . . . 0.0 110.982 175.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.25 -24.22 62.13 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 -176.205 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -78.19 -37.4 45.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.081 0.855 . . . . 0.0 111.253 168.934 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.28 -47.85 75.24 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.701 0.682 . . . . 0.0 110.132 -179.094 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -64.43 -30.78 71.81 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -175.448 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -89.99 -33.25 16.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.906 0.776 . . . . 0.0 112.709 174.899 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.09 -37.09 85.81 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.067 -1.021 . . . . 0.0 112.483 177.772 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -50.32 -63.12 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.361 1.064 . . . . 0.0 110.22 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -63.63 -29.76 70.96 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -179.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 . . . . . 0 CA--C 1.544 0.738 0 CA-C-N 119.065 0.848 . . . . 0.0 112.885 174.722 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.6 p . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 46.95 34.14 2.57 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 126.467 1.907 . . . . 0.0 113.564 -167.254 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.4 -9.01 19.76 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -177.475 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -71.48 14.87 0.15 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 127.074 2.149 . . . . 0.0 115.516 -172.805 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -92.23 -4.55 53.93 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.982 2.513 . . . . 0.0 115.048 -166.025 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 57.2 m -145.77 -46.12 0.21 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.103 1.761 . . . . 0.0 110.475 -168.544 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.4 pt -64.65 167.16 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.57 1.148 . . . . 0.0 111.575 173.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 67.07 -9.9 0.35 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 126.496 1.919 . . . . 0.0 115.928 -176.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -143.59 19.65 1.85 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.659 1.118 . . . . 0.0 113.792 -176.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -152.49 -40.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.424 1.089 . . . . 0.0 112.921 -176.144 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 124.847 1.259 . . . . 0.0 112.699 175.742 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 mp . . . . . 0 C--O 1.234 0.264 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 85.1 p -97.76 -71.4 0.69 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.641 1.176 . . . . 0.0 111.667 169.026 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -163.67 -34.31 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 124.575 1.15 . . . . 0.0 111.666 -168.354 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.83 -32.81 46.32 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.819 -0.55 . . . . 0.0 111.705 173.742 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -75.09 -39.16 60.94 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.174 -0.954 . . . . 0.0 112.527 -170.077 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -67.66 -28.51 67.76 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.27 -0.894 . . . . 0.0 112.406 172.787 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -67.5 -6.88 21.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 168.476 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -101.56 -39.72 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.012 1.325 . . . . 0.0 111.052 170.825 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.6 t -90.48 -54.15 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 119.059 0.845 . . . . 0.0 113.141 -174.563 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.14 -35.66 81.5 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.104 0.865 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.26 -33.43 71.03 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.22 -38.09 60.83 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.095 -1.003 . . . . 0.0 111.767 176.442 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -61.84 -26.99 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 120.858 -1.151 . . . . 0.0 111.229 173.009 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.4 m -79.51 -12.13 59.88 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 170.187 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.7 -39.5 6.32 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.622 1.101 . . . . 0.0 112.821 -172.462 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -132.64 -15.53 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -171.58 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.37 -82.1 0.34 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 125.417 1.484 . . . . 0.0 111.62 171.377 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 35.6 tp -171.66 -34.51 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.471 1.908 . . . . 0.0 111.236 177.026 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -107.69 -5.59 17.33 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -167.05 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -99.09 -22.46 15.68 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -62.65 157.94 19.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.917 1.287 . . . . 0.0 112.612 171.02 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.56 172.67 6.78 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.493 1.139 . . . . 0.0 112.094 177.617 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -18.55 30.27 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.988 1.315 . . . . 0.0 112.739 -179.058 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.7 m -66.5 -50.24 63.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.689 1.596 . . . . 0.0 111.417 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -65.92 -45.37 82.14 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.964 -1.085 . . . . 0.0 111.973 179.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mp -53.25 -52.73 58.06 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.763 0.825 . . . . 0.0 112.862 170.035 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.7 p -63.6 -28.22 69.78 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 120.738 -1.226 . . . . 0.0 113.669 -179.351 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -75.81 -44.24 42.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.3 1.44 . . . . 0.0 112.783 177.312 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.6 mmt-85 -86.89 -39.21 16.02 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.586 1.154 . . . . 0.0 113.742 -176.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -85.06 -17.74 36.49 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.691 1.597 . . . . 0.0 111.663 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 61.66 64.14 1.07 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.978 1.711 . . . . 0.0 111.825 178.892 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 16.0 pt -132.53 162.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 127.547 2.339 . . . . 0.0 109.104 178.502 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.1 t -68.35 149.92 48.81 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.495 -0.753 . . . . 0.0 110.338 166.87 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.4 t -57.43 -34.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.987 0.915 . . . . 0.0 111.078 -177.853 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.35 -33.12 73.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 178.781 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -67.72 -35.44 78.77 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.915 0.78 . . . . 0.0 111.181 171.317 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.82 -48.78 62.7 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.796 0.726 . . . . 0.0 110.615 176.421 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -57.81 -32.11 67.24 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.564 1.546 . . . . 0.0 113.665 179.051 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.1 t -89.71 -43.18 10.88 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.024 0.829 . . . . 0.0 113.003 174.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -58.75 -36.95 75.18 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.76 1.164 . . . . 0.0 113.129 -177.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mt -48.96 -48.09 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 125.063 1.345 . . . . 0.0 111.731 173.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -91.66 -25.34 19.18 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 179.438 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 . . . . . 0 CA--C 1.544 0.716 0 CA-C-N 119.397 0.999 . . . . 0.0 112.38 179.493 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.6 m . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -153.11 28.09 0.52 Allowed 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.418 168.935 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -111.85 33.58 4.71 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.979 1.712 . . . . 0.0 111.967 -172.511 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -124.99 17.52 8.52 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.764 1.626 . . . . 0.0 113.21 -173.808 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -76.82 -6.17 51.23 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.107 2.163 . . . . 0.0 115.873 -175.593 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.0 t -137.17 -38.63 0.61 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.434 1.494 . . . . 0.0 112.137 177.146 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.1 mt -63.23 157.85 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.299 1.44 . . . . 0.0 109.178 167.615 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.5 -24.2 0.06 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 127.321 2.248 . . . . 0.0 116.858 -177.29 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -101.83 -25.71 13.72 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.122 1.369 . . . . 0.0 114.439 175.894 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.08 -4.68 59.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 171.387 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 . . . . . 0 CA--C 1.544 0.726 0 C-N-CA 125.513 1.525 . . . . 0.0 112.077 -178.961 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 t -76.96 -79.56 0.11 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.503 1.121 . . . . 0.0 112.886 -173.39 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.47 -44.06 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.579 0.752 . . . . 0.0 111.403 -170.754 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -72.57 -28.34 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.027 0.531 . . . . 0.0 111.08 171.797 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -72.36 -49.73 32.01 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.448 1.099 . . . . 0.0 112.043 -171.167 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -65.37 -25.47 67.58 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.304 -1.497 . . . . 0.0 113.481 172.188 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -66.95 -5.54 13.12 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 167.478 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.31 -52.68 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.121 1.368 . . . . 0.0 110.043 167.153 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.8 t -79.41 -51.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.039 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.41 -32.95 74.18 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 118.982 0.81 . . . . 0.0 110.948 179.065 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.03 -36.35 74.82 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 167.773 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -40.67 70.34 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.123 -0.986 . . . . 0.0 111.776 175.72 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.2 -31.16 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 O-C-N 120.86 -1.15 . . . . 0.0 111.133 172.233 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -72.79 -17.23 61.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 171.693 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -102.49 -42.72 5.86 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.725 -1.234 . . . . 0.0 112.641 -170.665 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.98 -12.86 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -171.871 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.21 -82.54 0.34 Allowed Glycine 0 N--CA 1.469 0.852 0 C-N-CA 125.389 1.471 . . . . 0.0 112.59 167.095 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 65.5 tp -167.64 -36.27 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.263 1.825 . . . . 0.0 111.666 -179.117 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -112.29 -10.14 13.83 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.189 1.396 . . . . 0.0 114.645 -167.475 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -93.43 -15.31 25.75 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.158 0.983 . . . . 0.0 112.886 179.233 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -71.78 164.92 25.11 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.23 1.412 . . . . 0.0 113.533 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -110.13 118.63 36.9 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.637 1.175 . . . . 0.0 111.626 -179.501 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.7 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.639 1.176 . . . . 0.0 113.389 176.501 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.8 m -69.43 -41.38 76.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.313 -0.867 . . . . 0.0 111.543 173.543 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -61.3 -41.26 96.69 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.796 -1.19 . . . . 0.0 111.736 172.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.87 -46.32 81.89 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.675 -0.64 . . . . 0.0 111.795 168.787 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.1 p -60.59 -22.41 63.68 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.516 -1.365 . . . . 0.0 113.887 178.821 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -94.66 -43.04 8.46 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.114 1.766 . . . . 0.0 112.064 -175.492 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.4 mmt85 -79.22 -37.61 37.69 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.249 1.419 . . . . 0.0 112.835 176.872 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tp -98.88 -12.02 21.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.956 1.702 . . . . 0.0 113.544 -173.064 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.76 55.62 4.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.116 1.367 . . . . 0.0 112.643 176.218 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 10.1 pt -123.23 163.98 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 126.971 2.108 . . . . 0.0 110.731 174.913 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 58.8 m -57.88 139.44 54.2 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.711 1.204 . . . . 0.0 110.394 163.149 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -61.22 -33.82 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 O-C-N 121.116 -0.99 . . . . 0.0 111.642 -179.547 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -72.76 -31.98 65.29 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.34 -0.85 . . . . 0.0 112.946 176.281 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.27 -39.56 94.92 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.683 167.121 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.18 -49.78 72.91 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.147 0.885 . . . . 0.0 110.896 178.745 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -33.95 73.38 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -179.737 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -86.12 -40.52 15.6 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.348 0.976 . . . . 0.0 112.825 175.689 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.45 -37.39 75.33 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.974 1.31 . . . . 0.0 113.056 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.3 mt -49.05 -39.8 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.953 1.301 . . . . 0.0 111.708 171.785 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -90.25 -32.5 16.53 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.718 1.207 . . . . 0.0 113.531 178.333 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 m120 . . . . . 0 CA--C 1.543 0.703 0 CA-C-N 118.688 0.676 . . . . 0.0 111.842 -176.633 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 62.4 p . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 61.29 19.36 10.07 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.836 1.654 . . . . 0.0 113.451 -176.045 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -82.08 -13.22 57.61 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.583 1.953 . . . . 0.0 113.974 -178.483 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -74.17 14.71 0.39 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.642 1.977 . . . . 0.0 114.83 -172.097 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -80.24 -19.12 47.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.397 1.479 . . . . 0.0 112.974 -170.79 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.3 m -122.72 -39.07 2.56 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.599 1.96 . . . . 0.0 111.477 -172.834 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.4 mt -67.27 158.82 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.559 1.144 . . . . 0.0 108.415 165.131 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.6 ttmm 67.51 -10.58 0.35 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 167.644 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.3 ptt? -83.6 -26.37 30.06 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.113 0.869 . . . . 0.0 113.162 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 p90 -121.57 -10.83 8.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.844 1.258 . . . . 0.0 114.359 -175.172 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 . . . . . 0 CA--C 1.541 0.599 0 C-N-CA 124.64 1.176 . . . . 0.0 111.788 -176.871 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.524 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 58.9 p -149.5 160.01 43.82 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.487 1.515 . . . . 0.0 112.117 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 32.8 t60 -101.01 123.95 45.98 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.39 1.076 . . . . 0.0 110.97 175.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 90.8 mtp -134.49 110.96 9.72 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.002 1.321 . . . . 0.0 109.923 177.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -134.49 -58.41 0.83 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.059 1.343 . . . . 0.0 112.189 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.4 m 51.03 32.28 7.41 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 174.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 mmt -146.46 -44.86 0.19 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.369 1.867 . . . . 0.0 112.371 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -88.4 0.1 56.6 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.472 1.509 . . . . 0.0 112.891 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.24 28.23 1.7 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.551 1.14 . . . . 0.0 113.297 -164.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -100.87 69.59 1.35 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.954 1.301 . . . . 0.0 110.771 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -139.44 -50.19 0.5 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.212 1.005 . . . . 0.0 113.288 177.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -126.65 122.71 35.76 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.164 1.386 . . . . 0.0 109.568 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.9 mm -133.48 122.2 43.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.604 1.562 . . . . 0.0 108.928 -171.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.5 tt -149.06 147.3 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 124.95 1.3 . . . . 0.0 111.646 -174.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -102.63 -27.79 12.53 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -173.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -142.62 137.69 30.2 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.886 1.274 . . . . 0.0 111.709 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 25.7 pt -133.14 4.95 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.671 1.188 . . . . 0.0 114.189 -174.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -144.84 165.98 26.55 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.485 1.514 . . . . 0.0 112.38 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -82.6 12.66 4.39 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.01 1.724 . . . . 0.0 114.97 -172.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -138.42 152.01 47.98 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 126.911 2.084 . . . . 0.0 110.755 178.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -147.87 -82.97 0.12 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.601 1.16 . . . . 0.0 111.94 175.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.2 mp -127.73 6.42 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 126.485 1.914 . . . . 0.0 112.199 -176.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -92.88 2.46 56.76 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.634 -1.291 . . . . 0.0 114.003 -171.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -125.79 -44.78 1.78 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.847 1.259 . . . . 0.0 112.898 -174.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -71.29 -26.97 63.09 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.004 1.321 . . . . 0.0 114.501 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.5 t -90.25 -31.27 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 125.022 1.329 . . . . 0.0 111.544 175.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.0 t -132.04 85.47 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 125.202 1.401 . . . . 0.0 110.204 -175.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.6 tp -110.41 138.02 47.34 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.861 1.264 . . . . 0.0 111.897 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -137.4 38.62 2.48 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.024 1.73 . . . . 0.0 112.586 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -128.07 56.16 19.92 Favored Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 124.686 1.195 . . . . 0.0 113.341 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -77.39 74.64 5.02 Favored 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 123.749 2.966 . . . . 0.0 111.598 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 34.8 mmt-85 -124.6 -54.3 1.66 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.02 1.328 . . . . 0.0 113.82 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.8 t -136.75 88.86 18.45 Favored Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 124.426 1.09 . . . . 0.0 110.599 -173.046 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.09 155.77 26.05 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.729 2.286 . . . . 0.0 113.317 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.1 p -85.92 56.07 3.81 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 127.461 2.304 . . . . 0.0 113.652 -171.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -83.51 16.88 2.39 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -171.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -90.99 69.37 6.29 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.984 1.714 . . . . 0.0 111.837 -166.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.4 t -132.34 34.84 3.71 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.118 1.367 . . . . 0.0 113.25 -172.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.75 45.72 9.13 Favored Glycine 0 CA--C 1.535 1.309 0 O-C-N 120.763 -1.211 . . . . 0.0 113.474 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -99.47 35.99 1.85 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.307 1.843 . . . . 0.0 112.599 -168.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 64.27 99.26 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 128.076 2.551 . . . . 0.0 113.752 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.9 m -93.17 -73.13 0.57 Allowed 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.186 -0.946 . . . . 0.0 113.061 -168.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -162.61 -45.68 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.939 0.496 . . . . 0.0 111.432 -174.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.77 -33.89 76.61 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.641 0.777 . . . . 0.0 110.577 174.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.0 -38.75 83.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.602 1.161 . . . . 0.0 111.375 -176.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -64.89 -37.76 88.7 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 172.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -66.12 -2.42 4.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 171.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.6 mt -105.21 -53.29 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.104 1.362 . . . . 0.0 110.432 165.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.3 t -69.96 -64.06 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.059 0.845 . . . . 0.0 111.817 -173.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.62 -30.74 68.55 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 111.704 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -55.87 -36.93 68.14 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 166.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.34 -37.9 60.45 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.241 1.016 . . . . 0.0 112.311 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mm -61.5 -30.96 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 121.044 -1.035 . . . . 0.0 110.501 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 t -72.81 -17.0 61.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.91 1.284 . . . . 0.0 114.286 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -101.38 -42.66 6.2 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.601 -1.312 . . . . 0.0 112.745 -169.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.6 m -129.04 -13.31 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -169.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.88 -78.26 0.38 Allowed Glycine 0 N--CA 1.47 0.915 0 C-N-CA 125.187 1.375 . . . . 0.0 112.198 165.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tp -160.6 -45.87 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.592 1.157 . . . . 0.0 112.287 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -109.74 -8.28 14.95 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.801 1.64 . . . . 0.0 114.28 -167.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -88.72 -14.29 37.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.873 0.869 . . . . 0.0 112.852 -175.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -66.52 166.67 12.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.724 1.21 . . . . 0.0 112.082 164.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -119.09 165.16 14.5 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 122.427 1.108 . . . . 0.0 111.716 170.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.89 -26.78 59.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.551 1.14 . . . . 0.0 112.679 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -65.38 -46.06 81.56 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 112.123 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -67.37 -27.92 67.52 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.578 -1.326 . . . . 0.0 113.088 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.37 -56.92 6.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.201 1.0 . . . . 0.0 111.695 167.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.2 p -60.3 -26.68 66.7 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.565 1.146 . . . . 0.0 113.703 -177.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -70.37 -27.41 64.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.12 1.368 . . . . 0.0 113.74 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -114.08 -31.57 6.31 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.753 1.221 . . . . 0.0 113.454 -174.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.3 mt -84.69 -19.03 33.45 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.413 1.485 . . . . 0.0 112.723 173.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.53 22.38 12.09 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 126.166 1.786 . . . . 0.0 114.164 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.5 pt -73.64 164.84 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.963 1.705 . . . . 0.0 110.538 163.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.3 t -76.34 156.8 33.01 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.512 -0.742 . . . . 0.0 110.946 166.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.09 -38.37 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.01 0.924 . . . . 0.0 111.487 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -70.08 -31.39 68.96 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -67.93 -36.67 80.55 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.076 168.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.05 -47.33 71.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.445 1.02 . . . . 0.0 111.196 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.9 mtpt -55.3 -43.38 74.77 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.536 1.534 . . . . 0.0 112.631 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -82.5 -38.23 24.14 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.8 -39.3 73.88 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.866 -1.146 . . . . 0.0 112.59 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.9 mt -48.94 -65.98 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.338 1.455 . . . . 0.0 110.453 173.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -64.91 -27.14 68.65 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -73.35 -36.67 66.17 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.463 1.029 . . . . 0.0 112.841 -177.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.7 m -80.05 -39.13 30.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.953 0.901 . . . . 0.0 112.899 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.81 88.75 1.63 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.379 1.072 . . . . 0.0 111.458 -175.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -73.81 -42.96 60.2 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.049 0.94 . . . . 0.0 113.299 178.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 24.5 mmt -102.62 -19.93 14.63 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.214 1.406 . . . . 0.0 113.576 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.63 133.76 4.66 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.299 0.952 . . . . 0.0 110.865 -168.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 46.84 36.05 3.64 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.643 1.577 . . . . 0.0 113.665 -177.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 47.43 33.25 2.67 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 127.382 2.273 . . . . 0.0 113.768 -176.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.4 4.93 0.38 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.688 1.995 . . . . 0.0 115.575 -172.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.57 -10.84 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 120.145 -1.597 . . . . 0.0 113.647 -173.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -68.03 9.25 0.32 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.12 2.168 . . . . 0.0 115.352 -176.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -92.01 -6.0 51.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 128.611 2.764 . . . . 0.0 114.234 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.2 m -141.47 -45.66 0.37 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.138 1.775 . . . . 0.0 110.489 -170.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.0 pt -64.09 168.12 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 123.689 0.796 . . . . 0.0 111.193 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? 69.06 -14.94 0.28 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 126.694 1.998 . . . . 0.0 116.241 -177.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.39 19.72 2.39 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 120.414 1.461 . . . . 0.0 114.777 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -142.94 -24.58 0.62 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.169 1.544 . . . . 0.0 115.169 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -83.13 130.17 35.09 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.228 -0.92 . . . . 0.0 111.728 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -147.58 155.35 41.75 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.671 1.588 . . . . 0.0 111.61 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -74.85 145.56 42.69 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.049 0.94 . . . . 0.0 112.007 172.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.4 t -123.2 -47.11 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 124.734 1.214 . . . . 0.0 111.512 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.2 m -125.82 25.98 6.74 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.378 1.471 . . . . 0.0 112.685 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . 0.256 85.8 p 47.92 35.02 4.45 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.0 2.12 . . . . 0.0 115.348 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -138.44 158.02 45.07 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.08 1.752 . . . . 0.0 112.292 -176.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 69.1 m -144.67 141.1 29.08 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.422 1.489 . . . . 0.0 110.689 -175.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.85 15.5 1.15 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.889 1.676 . . . . 0.0 115.367 -175.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.1 mm-40 -82.03 153.3 69.45 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.889 1.276 . . . . 0.0 111.707 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.71 115.0 3.16 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.11 2.54 . . . . 0.0 111.224 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -139.88 91.68 2.49 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.877 1.671 . . . . 0.0 109.6 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.55 91.0 35.58 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.08 1.352 . . . . 0.0 109.518 -175.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 C--O 1.253 1.236 0 C-N-CA 123.963 3.109 . . . . 0.0 113.4 -176.237 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.504 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 52.3 m -120.24 151.81 38.64 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.258 1.423 . . . . 0.0 112.132 -178.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -111.37 32.84 5.06 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.241 1.416 . . . . 0.0 112.896 -172.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 67.0 mtt -86.38 79.12 9.12 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.166 1.386 . . . . 0.0 110.869 -176.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -122.1 -70.92 0.75 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.931 1.293 . . . . 0.0 112.549 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 16.6 m 53.26 25.38 4.36 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 117.056 2.243 . . . . 0.0 117.056 171.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.7 mtm -146.8 -33.17 0.3 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.839 1.256 . . . . 0.0 114.316 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -94.66 -2.41 51.33 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.663 1.585 . . . . 0.0 113.143 -174.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.44 38.08 1.25 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.101 1.36 . . . . 0.0 112.038 -162.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.8 mp -104.73 40.2 1.54 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.505 1.522 . . . . 0.0 112.037 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -143.05 99.48 3.46 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.829 1.652 . . . . 0.0 107.927 174.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -83.42 106.63 15.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.549 1.14 . . . . 0.0 111.107 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.6 mp -98.78 75.32 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.018 0.927 . . . . 0.0 111.091 -171.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.6 tt -147.97 150.24 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.514 1.126 . . . . 0.0 111.971 175.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -147.56 -38.34 0.2 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.697 1.199 . . . . 0.0 112.613 175.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.411 ' HG2' ' H ' ' A' ' 11' ' ' ILE . 9.6 tt0 -138.57 179.54 6.41 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.642 1.577 . . . . 0.0 111.201 175.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.411 ' H ' ' HG2' ' A' ' 10' ' ' GLN . 16.4 tt -118.06 122.88 70.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 127.555 2.342 . . . . 0.0 109.865 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -161.2 174.12 14.08 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.755 2.422 . . . . 0.0 111.098 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -71.9 85.78 0.97 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.683 1.593 . . . . 0.0 110.568 174.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -72.15 31.91 0.06 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 128.4 2.68 . . . . 0.0 116.921 -169.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.22 -11.15 37.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 116.896 2.184 . . . . 0.0 116.896 -166.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.6 mt -78.71 -14.62 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.726 1.61 . . . . 0.0 114.126 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -74.66 -12.14 60.36 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.001 1.111 . . . . 0.0 114.001 -173.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.7 m -85.45 -26.89 26.07 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -96.91 -13.75 22.22 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -174.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.2 t -72.5 -31.33 37.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.512 1.125 . . . . 0.0 111.476 177.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.3 t -92.8 68.54 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.068 1.347 . . . . 0.0 110.739 -176.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.3 tp -129.31 151.13 50.3 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.292 1.437 . . . . 0.0 111.92 173.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -83.56 23.84 0.91 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.332 1.853 . . . . 0.0 114.326 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -34.57 99.12 0.16 Allowed Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 128.491 2.717 . . . . 0.0 114.359 -171.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -97.94 68.89 0.09 OUTLIER 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 122.804 2.336 . . . . 0.0 112.222 -164.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 mtp-105 -124.5 -38.33 2.42 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.8 t -123.79 84.88 53.86 Favored Pre-proline 0 N--CA 1.48 1.067 0 C-N-CA 124.729 1.211 . . . . 0.0 110.639 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -76.79 171.62 17.66 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.45 2.767 . . . . 0.0 112.949 174.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.1 p -113.89 64.02 0.66 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.651 1.98 . . . . 0.0 112.737 -170.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -75.66 31.44 0.11 Allowed 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 115.954 1.835 . . . . 0.0 115.954 -175.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt -83.12 72.31 10.13 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.199 1.4 . . . . 0.0 111.279 -173.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.6 t -129.56 26.58 5.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.447 1.499 . . . . 0.0 113.22 -170.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.95 16.64 5.27 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 125.909 1.719 . . . . 0.0 114.912 178.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -105.03 30.89 5.2 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.714 2.006 . . . . 0.0 112.352 -175.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 tp 57.81 79.1 0.21 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.597 2.359 . . . . 0.0 113.908 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.1 m -95.5 -69.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.284 . . . . 0.0 112.729 -168.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -161.72 -43.42 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -172.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -73.4 -26.05 60.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.139 0.576 . . . . 0.0 110.59 175.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 -69.73 -41.57 75.13 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.357 1.463 . . . . 0.0 110.391 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -62.47 -36.27 81.94 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.807 0.843 . . . . 0.0 112.834 168.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -65.37 -3.97 4.91 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.6 mt -109.29 -20.59 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.834 1.654 . . . . 0.0 112.393 173.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.6 t -122.89 -53.88 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 CA-C-N 119.463 1.028 . . . . 0.0 113.634 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.83 -33.34 73.97 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.616 1.098 . . . . 0.0 110.948 171.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.76 -43.88 97.42 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.874 0.87 . . . . 0.0 113.055 167.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -36.24 78.16 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.624 1.17 . . . . 0.0 112.131 -178.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.95 -24.62 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 124.883 1.273 . . . . 0.0 111.649 171.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -80.56 -16.86 53.16 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.025 1.121 . . . . 0.0 114.025 171.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -94.82 -50.65 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.668 -1.27 . . . . 0.0 112.009 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 m -123.53 -13.84 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -167.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 124.2 -75.42 0.39 Allowed Glycine 0 N--CA 1.469 0.888 0 C-N-CA 125.328 1.442 . . . . 0.0 112.913 163.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.5 tp -166.78 -40.74 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.437 1.495 . . . . 0.0 112.206 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -111.05 -5.19 14.84 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -168.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -93.48 -17.99 22.8 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.101 0.961 . . . . 0.0 112.99 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -68.29 163.82 22.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.782 1.233 . . . . 0.0 112.096 165.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -116.78 169.75 9.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 122.454 1.121 . . . . 0.0 111.645 172.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.03 -24.44 40.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.308 1.043 . . . . 0.0 112.651 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.0 m -65.26 -45.3 85.06 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.802 1.641 . . . . 0.0 112.292 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.94 -38.23 90.28 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.517 -1.365 . . . . 0.0 111.931 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.3 -51.09 71.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.5 0.72 . . . . 0.0 112.167 172.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.5 p -65.51 -31.11 71.99 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.699 0.799 . . . . 0.0 113.116 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -70.87 -41.71 71.04 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.29 1.436 . . . . 0.0 112.602 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -96.19 -35.14 11.4 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.484 1.113 . . . . 0.0 113.416 -169.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 tt -91.64 -17.29 25.75 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.14 1.776 . . . . 0.0 112.099 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 61.01 69.96 0.64 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.212 1.805 . . . . 0.0 112.712 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.9 pt -136.79 162.89 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 128.384 2.674 . . . . 0.0 109.136 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -70.15 152.53 44.19 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.382 -0.824 . . . . 0.0 111.038 167.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 t -58.92 -36.07 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.052 0.941 . . . . 0.0 111.379 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.84 -32.26 71.82 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -69.14 -35.52 76.46 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.592 -0.718 . . . . 0.0 111.117 171.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.25 -49.74 63.23 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.767 0.712 . . . . 0.0 110.568 175.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -54.11 -42.91 69.94 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.506 1.522 . . . . 0.0 112.563 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -87.02 -32.18 20.15 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -63.04 -37.77 88.51 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.505 -1.372 . . . . 0.0 112.25 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.6 mt -49.79 -44.77 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.624 1.17 . . . . 0.0 111.739 175.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -90.0 -25.2 20.98 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -73.95 -27.22 60.9 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.848 1.204 . . . . 0.0 112.627 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.7 t -83.49 -39.03 21.03 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.193 0.997 . . . . 0.0 113.516 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -111.31 -32.47 6.73 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -171.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 48.26 53.0 12.51 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 127.736 2.414 . . . . 0.0 114.175 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.6 mmm 64.29 -32.19 0.13 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 128.488 2.715 . . . . 0.0 115.655 -175.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 138.58 -34.29 2.12 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 126.354 1.93 . . . . 0.0 113.101 167.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -127.01 17.55 7.24 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.203 1.801 . . . . 0.0 113.216 175.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m 52.15 33.3 12.03 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.415 1.486 . . . . 0.0 112.297 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 m120 52.61 30.8 9.12 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.514 1.526 . . . . 0.0 114.739 -175.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.94 -1.01 38.31 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -68.7 13.75 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.628 1.971 . . . . 0.0 115.758 -175.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.7 pttt -91.65 -6.54 51.97 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.075 2.55 . . . . 0.0 114.318 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 90.0 m -136.93 -42.09 0.59 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.808 1.643 . . . . 0.0 111.393 -173.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.7 pt -69.42 169.43 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 123.738 0.815 . . . . 0.0 111.384 170.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 67.53 -29.17 0.15 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.199 2.199 . . . . 0.0 115.791 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.2 ptp -94.29 -34.89 12.67 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.648 1.179 . . . . 0.0 113.606 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -90.0 -25.67 20.74 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 173.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.45 131.98 14.79 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.162 0.985 . . . . 0.0 111.924 -173.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -159.39 65.49 0.39 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.011 1.324 . . . . 0.0 110.985 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -129.4 139.87 51.52 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.176 1.391 . . . . 0.0 111.738 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.5 t -133.42 -47.97 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 124.368 1.067 . . . . 0.0 112.698 -176.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.9 t -129.2 24.56 5.55 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.928 1.291 . . . . 0.0 112.487 -178.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.5 p 53.86 176.04 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 128.123 2.569 . . . . 0.0 115.283 -169.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -148.01 116.29 6.55 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.366 1.067 . . . . 0.0 111.544 177.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.0 m -141.53 121.14 13.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.614 1.566 . . . . 0.0 110.081 175.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.01 16.17 2.07 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.2 1.8 . . . . 0.0 115.77 -175.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -86.79 148.14 45.14 Favored Pre-proline 0 CA--C 1.544 0.736 0 C-N-CA 124.901 1.28 . . . . 0.0 111.987 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.82 120.52 7.43 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.283 2.656 . . . . 0.0 110.482 172.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -133.21 80.73 1.9 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.196 1.398 . . . . 0.0 110.189 -177.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -150.18 151.04 30.95 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 126.128 1.771 . . . . 0.0 111.745 -175.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo . . . . . 0 C--O 1.253 1.228 0 C-N-CA 123.814 3.009 . . . . 0.0 113.234 177.634 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.566 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 31.8 p -72.98 149.87 42.95 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.214 1.006 . . . . 0.0 112.875 176.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -149.63 133.65 17.11 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.877 1.271 . . . . 0.0 110.362 175.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 23.7 mmt -127.35 94.16 3.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.645 1.178 . . . . 0.0 110.839 -176.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -148.49 -54.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.251 1.42 . . . . 0.0 112.015 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 54.1 24.83 5.08 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 126.153 1.781 . . . . 0.0 115.485 177.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.4 mtt -143.91 -33.28 0.42 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.468 1.507 . . . . 0.0 113.906 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -95.97 -1.85 48.23 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.439 1.496 . . . . 0.0 112.377 172.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -149.4 60.03 1.02 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.554 1.542 . . . . 0.0 110.546 -166.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -142.88 148.22 36.63 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.864 1.265 . . . . 0.0 112.174 167.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -146.75 -54.75 0.25 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.565 1.146 . . . . 0.0 112.534 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -116.58 114.7 24.49 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.251 1.421 . . . . 0.0 110.216 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.3 mm -129.89 110.46 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.694 1.598 . . . . 0.0 108.309 -177.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.7 tt -142.72 9.9 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 124.364 1.066 . . . . 0.0 113.753 -172.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -101.12 107.97 19.53 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.803 -1.186 . . . . 0.0 110.882 177.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -158.29 -53.85 0.07 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.671 1.188 . . . . 0.0 111.943 174.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.8 pt -144.39 111.48 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 126.746 2.019 . . . . 0.0 109.515 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -159.1 150.28 20.16 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.667 1.187 . . . . 0.0 110.925 -176.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -80.95 77.85 7.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.068 0.947 . . . . 0.0 110.598 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.62 33.45 0.07 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 -174.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.55 -72.31 0.25 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.44 1.896 . . . . 0.0 113.347 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 66.3 mt -123.81 -7.88 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.596 1.558 . . . . 0.0 112.985 -173.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -72.03 -12.71 61.35 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -172.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.5 t -93.98 -56.34 2.9 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.357 1.063 . . . . 0.0 112.499 173.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -71.64 -14.06 61.94 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -170.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.2 p -69.87 -23.18 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.274 1.03 . . . . 0.0 112.47 174.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.6 t -91.63 59.11 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 125.343 1.457 . . . . 0.0 110.699 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 22.5 mt -137.2 132.11 33.42 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.355 1.462 . . . . 0.0 112.099 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -135.7 19.94 3.3 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 126.418 1.887 . . . . 0.0 113.633 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -125.73 49.57 3.71 Favored Pre-proline 0 CA--C 1.559 1.324 0 C-N-CA 125.334 1.454 . . . . 0.0 113.751 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -80.15 66.73 8.78 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.568 2.845 . . . . 0.0 113.007 -174.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 73.6 mtt85 -112.76 -42.8 3.54 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.129 1.372 . . . . 0.0 114.354 -177.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.2 t 37.9 80.21 0.28 Allowed Pre-proline 0 N--CA 1.48 1.045 0 C-N-CA 128.113 2.565 . . . . 0.0 113.59 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.51 165.82 27.86 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.862 2.375 . . . . 0.0 113.95 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.7 p -119.73 61.88 0.83 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.627 1.571 . . . . 0.0 112.964 -157.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -99.42 18.57 17.45 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -169.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.24 27.09 0.26 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.988 2.115 . . . . 0.0 113.865 -172.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -145.2 14.53 1.47 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.821 1.248 . . . . 0.0 114.02 -164.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.7 37.27 0.72 Allowed Glycine 0 N--CA 1.475 1.297 0 O-C-N 120.626 -1.297 . . . . 0.0 114.209 -175.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -105.94 17.25 23.93 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -167.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp -129.75 137.65 50.66 Favored 'General case' 0 C--N 1.343 0.287 0 C-N-CA 126.087 1.755 . . . . 0.0 109.444 176.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.9 m -114.46 -73.25 0.66 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.904 1.682 . . . . 0.0 112.855 -176.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -160.17 -32.38 0.06 Allowed 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -170.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -83.15 -27.43 30.1 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.909 0.484 . . . . 0.0 111.226 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -75.4 -42.81 52.86 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.815 1.246 . . . . 0.0 111.437 -169.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -70.8 -26.69 63.43 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.995 0.918 . . . . 0.0 112.61 174.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -66.54 -4.71 9.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 166.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.1 mt -107.09 -52.83 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.14 1.376 . . . . 0.0 110.258 166.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.82 -57.85 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.231 0.923 . . . . 0.0 111.581 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.64 67.82 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.366 0.53 . . . . 0.0 111.777 -177.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -57.85 -36.92 72.97 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 167.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -38.19 70.34 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.195 0.998 . . . . 0.0 111.852 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -58.81 -35.01 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 O-C-N 120.24 -1.538 . . . . 0.0 110.749 174.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.2 m -77.15 -4.94 47.13 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -107.26 -29.94 9.02 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.936 1.244 . . . . 0.0 113.436 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.3 p -136.21 -22.22 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 -171.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 140.05 -86.31 0.21 Allowed Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.663 1.125 . . . . 0.0 111.801 174.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.5 tp -159.54 -42.98 0.05 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.844 1.258 . . . . 0.0 112.397 174.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -117.3 2.92 12.58 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -168.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -94.95 -17.04 22.33 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.295 0.638 . . . . 0.0 112.281 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.98 161.73 18.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.122 1.369 . . . . 0.0 112.087 168.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -110.78 162.3 14.91 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.564 1.173 . . . . 0.0 111.557 168.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.81 -24.94 48.64 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.614 1.166 . . . . 0.0 112.584 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.2 m -64.02 -47.17 81.31 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.907 1.683 . . . . 0.0 111.731 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -62.59 -40.47 97.01 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.753 1.221 . . . . 0.0 113.074 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.51 -51.53 69.07 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.051 0.94 . . . . 0.0 111.278 168.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.1 m -58.76 -30.38 67.48 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.341 1.456 . . . . 0.0 113.167 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -79.4 -18.52 52.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.554 1.542 . . . . 0.0 113.511 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -110.04 -36.66 5.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.194 1.398 . . . . 0.0 113.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.24 -19.57 46.58 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.364 1.066 . . . . 0.0 112.663 171.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.12 63.12 1.48 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.175 1.39 . . . . 0.0 111.366 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.6 pt -128.34 167.28 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.544 1.938 . . . . 0.0 111.947 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.1 m -65.06 134.53 54.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.954 1.702 . . . . 0.0 109.551 165.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.77 -34.37 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 122.992 0.517 . . . . 0.0 111.742 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.2 -28.76 66.66 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 177.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -68.87 -36.95 78.72 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.272 170.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.62 -49.08 61.98 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.704 0.684 . . . . 0.0 110.437 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -53.31 -42.63 66.87 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.119 1.368 . . . . 0.0 112.594 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -87.79 -32.63 18.98 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -62.62 -38.96 92.27 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.179 -0.951 . . . . 0.0 112.228 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.6 mt -48.06 -65.6 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.013 1.325 . . . . 0.0 109.851 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.76 -28.64 67.79 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 -77.54 -28.68 51.96 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 120.027 1.285 . . . . 0.0 113.152 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.0 t -79.56 -44.15 21.66 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.945 0.898 . . . . 0.0 111.902 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -150.54 87.13 1.42 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.252 1.421 . . . . 0.0 111.117 -176.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 64.9 ttt-85 -70.94 -44.16 66.66 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.634 1.174 . . . . 0.0 113.149 176.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 92.1 mtp -125.51 -21.32 4.53 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.69 1.596 . . . . 0.0 113.055 -176.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 108.98 -27.18 13.34 Favored Glycine 0 N--CA 1.476 1.318 0 C-N-CA 125.569 1.557 . . . . 0.0 115.019 166.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 58.6 mtt85 -122.25 28.97 7.2 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 126.306 1.842 . . . . 0.0 112.759 172.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.5 m 50.44 32.75 6.83 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.668 1.987 . . . . 0.0 113.145 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.259 0.8 OUTLIER 46.11 26.67 0.45 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.765 2.026 . . . . 0.0 115.977 -170.589 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -8.28 25.42 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.719 1.208 . . . . 0.0 114.155 -175.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -72.83 15.52 0.19 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.442 1.897 . . . . 0.0 115.058 -174.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -89.32 -5.13 57.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.093 2.557 . . . . 0.0 114.726 -169.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 93.8 m -138.19 -50.47 0.58 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.206 1.802 . . . . 0.0 109.954 -171.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.2 pt -66.9 165.08 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.813 1.245 . . . . 0.0 112.279 172.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.57 -7.2 0.19 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.452 2.301 . . . . 0.0 116.018 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 47.3 mtm -93.23 -44.1 8.5 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.875 1.216 . . . . 0.0 113.518 -178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -109.85 -6.05 15.35 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -76.46 159.34 30.5 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.052 1.341 . . . . 0.0 112.289 177.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -76.02 123.42 25.72 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.469 -0.769 . . . . 0.0 111.258 174.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -140.62 146.81 38.44 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.989 1.716 . . . . 0.0 110.399 175.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.3 t -122.93 -44.02 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.587 1.155 . . . . 0.0 111.217 -174.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 74.8 p -113.54 2.31 15.3 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.633 1.573 . . . . 0.0 114.267 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 t -138.02 26.06 2.73 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.84 1.656 . . . . 0.0 113.172 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.4 169.35 18.48 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.805 1.242 . . . . 0.0 112.649 176.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.6 t -129.62 165.67 21.31 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.388 1.475 . . . . 0.0 111.788 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -78.38 28.08 0.2 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.415 1.886 . . . . 0.0 113.944 -175.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 47.52 60.04 15.76 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 127.364 2.266 . . . . 0.0 113.686 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -77.81 57.12 5.93 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 124.963 3.775 . . . . 0.0 112.714 -177.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -136.7 95.0 3.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.662 1.585 . . . . 0.0 109.784 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.5 tp -121.43 91.39 48.29 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 125.525 1.53 . . . . 0.0 110.31 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 C--O 1.253 1.263 0 C-N-CA 123.862 3.041 . . . . 0.0 113.277 -178.974 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.537 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 5.9 t -72.26 164.01 26.99 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.881 0.872 . . . . 0.0 112.463 175.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -139.91 130.73 25.99 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.775 1.23 . . . . 0.0 110.98 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 89.2 mmm -131.23 105.3 7.57 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.405 1.482 . . . . 0.0 111.007 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -142.68 -44.27 0.31 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.843 1.257 . . . . 0.0 112.855 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 32.7 m 55.42 -10.04 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 118.485 2.772 . . . . 0.0 118.485 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.7 mtm -121.2 -9.64 9.09 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.239 1.816 . . . . 0.0 113.793 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -123.77 14.75 9.36 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.149 2.18 . . . . 0.0 111.326 174.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -156.18 8.0 0.22 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.171 1.389 . . . . 0.0 113.158 -149.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 tp -146.03 133.57 20.9 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.676 1.19 . . . . 0.0 111.4 -175.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 54.51 15.07 0.92 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.561 1.944 . . . . 0.0 115.73 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -104.86 83.46 2.01 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.705 1.602 . . . . 0.0 110.936 -177.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.9 mp -123.36 68.72 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.375 1.47 . . . . 0.0 108.545 176.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.1 mt -128.97 137.26 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 126.165 1.786 . . . . 0.0 108.77 -178.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -144.47 157.56 44.18 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.328 1.451 . . . . 0.0 110.749 -177.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -62.14 141.38 58.19 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.505 -0.747 . . . . 0.0 112.362 176.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 33.5 pt -138.08 133.08 43.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 126.575 1.95 . . . . 0.0 109.971 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -133.33 -78.29 0.48 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.8 1.64 . . . . 0.0 109.97 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -152.36 25.12 0.61 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.497 1.919 . . . . 0.0 112.487 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -70.39 -30.31 67.17 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.754 -1.217 . . . . 0.0 112.836 -175.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 48.92 29.37 2.31 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.728 1.611 . . . . 0.0 113.777 -172.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . 0.281 5.2 mp 61.23 7.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 127.088 2.155 . . . . 0.0 114.073 -174.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.67 -19.58 61.4 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.102 -1.624 . . . . 0.0 113.555 -170.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 51.0 m -97.18 -46.1 6.27 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.432 0.693 . . . . 0.0 112.23 -173.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -74.76 -13.45 60.59 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 91.7 t -94.84 -30.51 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.04 1.336 . . . . 0.0 112.228 174.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.1 t -129.53 87.8 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.86 1.264 . . . . 0.0 109.974 -177.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -137.8 131.75 31.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.169 1.388 . . . . 0.0 111.32 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.0 mttm -139.85 15.17 2.49 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -135.44 74.55 60.17 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 124.887 1.275 . . . . 0.0 112.664 -176.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -81.24 64.48 8.79 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.752 2.968 . . . . 0.0 112.364 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.9 mtt-85 -131.79 -55.64 1.0 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.366 1.466 . . . . 0.0 114.031 -176.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.0 t 41.7 64.96 5.09 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 127.263 2.225 . . . . 0.0 113.267 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.48 158.34 40.37 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.036 2.491 . . . . 0.0 113.838 -174.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.4 p -78.46 59.81 2.48 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 128.307 2.643 . . . . 0.0 113.76 -174.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -82.84 22.54 0.91 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.195 1.798 . . . . 0.0 115.736 -172.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -87.26 65.04 8.61 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.714 2.006 . . . . 0.0 112.37 -168.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.4 t -150.63 11.06 0.66 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -165.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -147.87 32.06 1.32 Allowed Glycine 0 N--CA 1.476 1.331 0 O-C-N 120.544 -1.347 . . . . 0.0 115.517 -169.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -76.98 -50.4 13.26 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.383 1.091 . . . . 0.0 113.927 -169.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.6 mp -142.18 133.8 26.81 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.344 1.858 . . . . 0.0 110.329 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 p -95.75 -87.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.657 1.983 . . . . 0.0 111.722 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -159.34 -36.96 0.06 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.494 1.118 . . . . 0.0 112.567 -172.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.44 -33.26 73.88 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.755 0.822 . . . . 0.0 110.471 168.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -72.23 -31.31 65.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.455 1.102 . . . . 0.0 111.404 -175.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -42.49 99.38 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.291 1.036 . . . . 0.0 113.722 165.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -60.42 -9.38 3.54 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 172.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.5 mt -99.26 -57.27 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.14 1.376 . . . . 0.0 111.153 166.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.29 -55.63 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 119.573 1.078 . . . . 0.0 112.8 -172.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.04 -32.67 74.5 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.674 -0.641 . . . . 0.0 111.056 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.76 -34.26 76.86 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -36.5 63.72 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.563 1.145 . . . . 0.0 111.703 174.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.89 -33.82 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.138 -1.601 . . . . 0.0 110.389 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.1 m -79.75 -3.54 48.01 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 170.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -101.27 -40.39 7.16 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.996 1.271 . . . . 0.0 112.501 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 p -132.98 -22.8 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 -169.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 142.98 -84.9 0.19 Allowed Glycine 0 N--CA 1.469 0.883 0 C-N-CA 124.559 1.076 . . . . 0.0 111.517 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -165.6 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 111.302 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -104.85 -9.31 18.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.591 1.556 . . . . 0.0 114.771 -166.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -92.17 -16.95 25.57 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.66 0.664 . . . . 0.0 112.713 -174.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.93 161.21 18.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.334 1.454 . . . . 0.0 114.521 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.1 t-20 -100.95 123.4 45.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.011 1.324 . . . . 0.0 110.948 -177.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.55 -28.84 70.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.673 1.189 . . . . 0.0 113.022 177.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.2 m -68.33 -42.63 79.03 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.555 0.742 . . . . 0.0 111.671 176.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -62.2 -37.83 86.82 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.37 -0.831 . . . . 0.0 112.382 175.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.38 -47.37 84.45 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.692 -0.63 . . . . 0.0 111.868 168.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -60.28 -27.16 67.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -76.0 -26.65 56.93 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.252 1.821 . . . . 0.0 112.941 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -105.18 -37.62 6.84 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.367 1.467 . . . . 0.0 112.885 -177.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -17.14 53.31 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.417 1.087 . . . . 0.0 112.453 173.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 59.49 60.23 2.35 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.205 1.402 . . . . 0.0 112.079 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.6 pt -128.76 175.76 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 127.971 2.509 . . . . 0.0 109.645 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.1 t -77.09 148.64 35.97 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.407 -0.808 . . . . 0.0 110.675 163.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.93 -29.78 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.37 1.068 . . . . 0.0 111.153 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -70.63 -29.65 66.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -73.87 -37.13 64.84 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.818 -0.61 . . . . 0.0 111.183 167.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.88 -47.07 76.06 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.425 0.557 . . . . 0.0 111.006 -177.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 53.8 pttt -70.6 -20.49 62.76 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -176.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -93.41 -39.27 11.01 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.085 0.857 . . . . 0.0 112.336 171.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.69 -42.57 75.39 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.139 -0.976 . . . . 0.0 112.292 177.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mt -47.39 -63.98 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.699 1.2 . . . . 0.0 110.455 175.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.3 pttt -73.37 -32.52 64.55 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -76.2 -34.59 59.28 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.801 0.728 . . . . 0.0 112.295 -177.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.2 t -85.31 -48.96 8.56 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.623 0.769 . . . . 0.0 112.665 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -115.41 85.34 2.25 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.477 1.111 . . . . 0.0 112.721 -178.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.94 -9.56 26.0 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 172.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 65.0 mtt -93.1 -46.35 7.48 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -172.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.76 127.16 3.2 Favored Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.672 1.13 . . . . 0.0 112.14 -174.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 72.8 mmt-85 46.86 33.64 2.28 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 125.628 1.571 . . . . 0.0 113.682 -176.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.1 m 47.15 33.22 2.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.946 2.098 . . . . 0.0 113.524 -174.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.68 31.91 13.62 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 114.3 -174.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.81 -9.26 23.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.778 1.231 . . . . 0.0 113.977 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -75.79 15.88 0.46 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.482 1.913 . . . . 0.0 115.05 -175.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -84.06 9.68 11.92 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.944 2.498 . . . . 0.0 115.165 -170.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -145.62 -46.5 0.21 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.397 1.879 . . . . 0.0 110.054 -168.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.1 mt -74.59 161.83 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.131 1.772 . . . . 0.0 109.289 175.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.72 -9.52 0.18 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 117.086 2.254 . . . . 0.0 117.086 177.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 36.8 mtm -93.12 -32.24 14.51 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -175.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -100.61 -10.79 20.61 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.255 1.022 . . . . 0.0 113.631 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -82.1 42.86 0.75 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 126.092 1.757 . . . . 0.0 113.185 -171.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -80.83 157.86 25.57 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.465 1.506 . . . . 0.0 114.341 -177.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.9 t0 62.25 160.44 0.07 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.592 2.357 . . . . 0.0 115.001 -173.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.3 t -138.8 -42.09 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.517 1.527 . . . . 0.0 111.822 -173.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.3 m -129.34 16.17 6.06 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.905 1.282 . . . . 0.0 113.169 -175.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.0 t 58.37 64.72 1.41 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.053 1.741 . . . . 0.0 113.105 -176.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.81 147.86 46.8 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.157 0.983 . . . . 0.0 112.35 175.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.5 m -138.64 117.35 12.25 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.701 1.2 . . . . 0.0 111.5 -176.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.53 29.9 7.75 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.481 1.513 . . . . 0.0 114.403 -175.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -123.06 149.85 58.03 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 127.067 2.147 . . . . 0.0 111.373 -173.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -80.32 61.12 8.11 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 124.283 3.322 . . . . 0.0 111.662 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 52.44 40.48 29.64 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.85 1.66 . . . . 0.0 112.72 -172.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.1 tt -116.54 100.46 53.45 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.966 1.706 . . . . 0.0 110.012 -170.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo . . . . . 0 C--O 1.253 1.269 0 C-N-CA 124.057 3.171 . . . . 0.0 113.494 -178.071 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.555 0 CA-C-O 121.149 0.305 . . . . 0.0 112.892 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 25.4 p -75.82 133.57 40.59 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.721 1.209 . . . . 0.0 112.85 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -156.09 109.67 2.73 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.612 1.565 . . . . 0.0 109.711 176.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 94.4 mtp -137.5 93.8 2.85 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.874 1.27 . . . . 0.0 110.291 175.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.41 98.35 2.38 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.913 1.285 . . . . 0.0 110.667 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 68.3 p -122.1 4.35 9.84 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.156 1.783 . . . . 0.0 114.607 -174.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 ptp -143.28 -7.99 0.78 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 115.583 1.697 . . . . 0.0 115.583 -168.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -133.21 12.5 4.22 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.279 1.832 . . . . 0.0 112.04 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.26 17.02 1.53 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.072 1.749 . . . . 0.0 112.202 -164.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.1 mp -115.82 75.09 0.93 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.029 1.732 . . . . 0.0 109.677 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -137.12 -4.71 1.9 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -175.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -98.72 86.38 3.53 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.012 1.325 . . . . 0.0 111.106 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.4 mp -130.45 71.86 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.415 1.486 . . . . 0.0 109.27 178.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 36.0 mm -130.62 144.25 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 126.336 1.854 . . . . 0.0 109.779 -177.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -125.92 124.8 41.61 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.858 1.263 . . . . 0.0 110.495 172.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -153.98 -46.15 0.09 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.716 1.206 . . . . 0.0 112.397 178.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.1 tt -153.68 121.93 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 126.74 2.016 . . . . 0.0 109.069 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -138.42 170.59 15.74 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.85 1.66 . . . . 0.0 111.217 -174.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -73.66 73.22 1.49 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.809 1.243 . . . . 0.0 110.374 167.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -73.22 108.25 6.0 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.688 1.195 . . . . 0.0 110.633 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.02 -69.67 0.66 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.45 1.1 . . . . 0.0 112.893 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -122.62 -11.76 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.57 1.148 . . . . 0.0 113.778 -173.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -74.0 -14.48 61.03 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -173.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.6 p -93.04 -63.67 1.19 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.709 1.604 . . . . 0.0 112.173 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -72.12 -10.61 60.02 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -170.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.3 p -74.54 -17.64 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.7 0.8 . . . . 0.0 112.574 172.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.3 t -119.32 75.39 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 125.788 1.635 . . . . 0.0 109.25 174.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.9 tp -139.4 150.63 45.52 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.764 1.225 . . . . 0.0 112.108 -174.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.04 45.6 2.67 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.706 1.602 . . . . 0.0 112.838 -171.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 49.05 72.64 1.19 Allowed Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 126.474 1.91 . . . . 0.0 114.246 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -77.64 61.66 7.55 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 124.311 3.341 . . . . 0.0 111.522 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? 53.38 55.54 8.57 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.275 2.23 . . . . 0.0 113.054 -176.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 32.0 t -114.48 89.16 17.33 Favored Pre-proline 0 N--CA 1.479 1.024 0 C-N-CA 125.194 1.398 . . . . 0.0 110.206 176.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.99 166.24 30.12 Favored 'Trans proline' 0 CA--C 1.534 0.525 0 C-N-CA 123.012 2.475 . . . . 0.0 112.926 171.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 p -127.0 70.88 1.3 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.643 1.577 . . . . 0.0 112.645 -163.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.433 ' NE2' ' H ' ' A' ' 30' ' ' GLN . 2.7 pm0 -95.87 23.25 6.48 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.926 1.691 . . . . 0.0 114.922 -177.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.81 60.86 4.9 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.36 1.864 . . . . 0.0 111.388 -174.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.2 t -141.01 10.9 2.18 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.957 1.303 . . . . 0.0 114.423 -171.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.83 -50.1 31.86 Favored Glycine 0 CA--C 1.535 1.312 0 O-C-N 120.764 -1.21 . . . . 0.0 114.179 -175.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 51.73 33.67 11.52 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.331 1.852 . . . . 0.0 115.057 173.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.0 mp 53.8 89.96 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.442 2.297 . . . . 0.0 113.835 -176.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.4 t -82.01 -73.06 0.41 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.914 0.886 . . . . 0.0 111.899 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -162.87 -36.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.053 0.541 . . . . 0.0 112.306 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -75.25 -33.4 61.29 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.733 0.413 . . . . 0.0 111.466 171.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -69.35 -42.12 75.71 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.427 -0.795 . . . . 0.0 112.264 -171.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 ptpt -70.44 -25.58 63.26 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.2 -0.938 . . . . 0.0 113.068 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -71.89 2.48 5.46 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 166.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.9 mt -110.78 -43.22 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.572 1.549 . . . . 0.0 110.895 168.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.8 t -79.8 -63.89 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 119.176 0.898 . . . . 0.0 112.447 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.06 -28.44 68.2 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.329 -0.857 . . . . 0.0 112.456 -175.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.71 -17.39 64.07 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 168.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -34.21 17.67 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.636 1.174 . . . . 0.0 111.093 170.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.5 mm -61.69 -21.76 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 120.537 -1.352 . . . . 0.0 112.451 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.4 p -90.3 -4.83 56.88 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 171.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -93.54 -56.81 2.79 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.993 1.269 . . . . 0.0 112.517 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.0 m -117.61 -37.85 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -166.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.45 -90.77 0.13 Allowed Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.08 1.324 . . . . 0.0 112.057 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.4 tp -167.35 -47.75 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.566 1.547 . . . . 0.0 111.52 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -96.03 19.36 11.74 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.626 1.57 . . . . 0.0 113.163 -168.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -149.54 -5.02 0.38 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.808 2.043 . . . . 0.0 113.268 -159.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.91 161.66 24.26 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.086 1.354 . . . . 0.0 112.396 172.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -98.62 113.99 26.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.376 0.608 . . . . 0.0 111.327 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.64 -23.23 65.92 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.379 1.472 . . . . 0.0 113.737 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.7 m -65.74 -38.23 88.55 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.132 0.973 . . . . 0.0 112.104 174.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -69.48 -35.18 75.33 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 120.599 -1.313 . . . . 0.0 112.146 177.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.57 -54.62 43.23 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.404 0.682 . . . . 0.0 110.82 167.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.7 p -66.58 -28.43 68.51 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -61.2 -52.31 65.35 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.93 1.692 . . . . 0.0 112.473 170.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.4 mtp-105 -87.1 -35.82 18.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -172.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.72 -18.85 46.5 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.464 1.506 . . . . 0.0 111.402 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.75 65.21 0.84 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.303 1.841 . . . . 0.0 112.008 177.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.1 pt -131.24 174.01 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 127.175 2.19 . . . . 0.0 110.566 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.0 m -69.38 139.11 54.13 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.083 1.353 . . . . 0.0 109.247 165.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.2 t -57.36 -39.14 66.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.301 0.64 . . . . 0.0 111.575 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -68.53 -27.94 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.442 0.905 . . . . 0.0 113.442 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.03 -35.14 76.28 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 111.286 173.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.07 64.07 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.854 0.752 . . . . 0.0 110.469 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.23 -37.32 69.55 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.528 1.131 . . . . 0.0 112.934 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.9 t -86.87 -35.96 18.72 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -63.35 -35.42 80.33 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.041 -1.037 . . . . 0.0 112.916 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mt -48.02 -44.37 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.99 1.316 . . . . 0.0 111.442 173.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -86.42 -34.86 20.02 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -67.1 -30.4 70.41 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 118.299 0.5 . . . . 0.0 112.082 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -81.27 -50.62 9.31 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.962 1.305 . . . . 0.0 113.712 176.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -95.35 -31.7 13.3 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -169.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.2 tpp85 44.2 36.11 1.43 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 128.846 2.858 . . . . 0.0 115.261 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.6 mtp 57.08 22.51 7.48 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.58 1.552 . . . . 0.0 114.422 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.15 40.26 2.54 Favored Glycine 0 N--CA 1.472 1.05 0 C-N-CA 125.249 1.404 . . . . 0.0 111.33 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? 53.48 -73.08 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.85 2.46 . . . . 0.0 111.215 -148.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.0 p -145.85 19.81 1.46 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.034 2.134 . . . . 0.0 114.084 -173.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 62.24 38.54 13.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 125.488 1.515 . . . . 0.0 113.18 -171.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -93.08 -2.78 55.19 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 175.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -72.46 16.25 0.15 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.407 1.883 . . . . 0.0 115.291 -175.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.0 pttp -83.84 -6.08 59.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.004 2.122 . . . . 0.0 113.655 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 61.9 m -138.24 -47.79 0.53 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.949 2.099 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.0 mt -76.83 156.0 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.776 1.23 . . . . 0.0 109.684 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 67.82 -4.43 0.98 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 127.415 2.286 . . . . 0.0 116.698 178.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 34.5 mtm -85.99 -49.08 8.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.704 1.138 . . . . 0.0 112.359 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -88.05 -19.29 27.31 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.574 1.15 . . . . 0.0 113.287 -174.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -97.64 13.1 31.37 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.18 1.792 . . . . 0.0 113.321 -172.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.87 112.57 12.42 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.597 1.159 . . . . 0.0 112.696 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -143.01 141.62 31.39 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.492 1.917 . . . . 0.0 110.475 173.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.7 t -134.7 -49.76 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.571 1.148 . . . . 0.0 111.695 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 71.6 p -116.62 17.33 15.32 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.745 1.618 . . . . 0.0 113.667 -176.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 74.8 m 50.18 33.76 7.65 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 126.522 1.929 . . . . 0.0 114.194 -174.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -141.65 165.12 28.35 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.956 2.102 . . . . 0.0 110.971 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.5 m -142.96 158.73 43.32 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.04 1.336 . . . . 0.0 111.627 -168.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.52 28.61 9.97 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.226 1.411 . . . . 0.0 114.699 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -69.82 149.3 96.61 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 125.307 1.443 . . . . 0.0 111.806 -176.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -69.79 104.92 1.4 Allowed 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.137 2.558 . . . . 0.0 110.818 175.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -142.51 89.69 2.17 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.228 1.411 . . . . 0.0 109.808 -174.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 97.8 mt -125.88 78.28 69.81 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.498 1.519 . . . . 0.0 110.735 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.254 1.282 0 C-N-CA 124.027 3.151 . . . . 0.0 113.315 -179.875 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 51.8 m -127.82 155.01 44.77 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.498 1.519 . . . . 0.0 111.973 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -115.51 121.81 43.82 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.85 1.26 . . . . 0.0 111.5 -177.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 92.6 mtp -139.12 109.58 6.56 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.389 1.476 . . . . 0.0 109.563 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -145.44 39.45 1.17 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.296 1.439 . . . . 0.0 112.381 -172.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 15.0 m -118.12 18.25 13.87 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.222 1.409 . . . . 0.0 114.212 -159.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -150.89 -10.72 0.23 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -173.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -124.5 7.22 8.29 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 126.127 1.771 . . . . 0.0 112.798 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.56 26.19 3.73 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.904 1.682 . . . . 0.0 111.864 -167.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.0 mp -118.68 60.47 0.8 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.728 1.611 . . . . 0.0 110.602 -177.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -139.32 -38.34 0.49 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.466 1.106 . . . . 0.0 113.485 -178.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -79.32 24.79 0.33 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.68 1.592 . . . . 0.0 114.221 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.7 mt -76.76 139.68 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 126.225 1.81 . . . . 0.0 111.142 -172.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 75.7 mt -109.26 133.54 54.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 125.523 1.529 . . . . 0.0 109.359 175.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -133.91 127.15 31.89 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.131 1.372 . . . . 0.0 110.245 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -154.4 -57.98 0.11 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.807 0.843 . . . . 0.0 112.447 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.7 pt -139.36 99.12 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.574 1.55 . . . . 0.0 110.671 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -132.02 -84.88 0.49 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.679 1.192 . . . . 0.0 110.584 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -147.76 25.99 1.03 Allowed 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.757 2.023 . . . . 0.0 111.861 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -76.78 122.53 24.9 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.678 1.191 . . . . 0.0 110.624 -174.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.61 -69.11 0.52 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.488 1.515 . . . . 0.0 112.856 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.6 mt -111.14 -1.64 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.063 1.745 . . . . 0.0 112.563 -171.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -72.67 -18.98 61.51 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.413 1.485 . . . . 0.0 112.261 -171.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.2 t -80.98 -44.71 17.73 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.388 1.075 . . . . 0.0 112.371 178.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -83.68 -18.08 39.24 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 -176.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.2 p -86.4 -13.88 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.452 1.101 . . . . 0.0 113.208 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.9 t -122.56 74.28 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.678 1.591 . . . . 0.0 109.86 177.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.4 tp -140.93 142.6 34.38 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.119 1.368 . . . . 0.0 111.669 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -134.32 35.73 3.22 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 125.959 1.704 . . . . 0.0 113.66 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -132.91 66.28 75.91 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 123.959 0.904 . . . . 0.0 113.223 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -80.47 61.83 8.34 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.713 2.942 . . . . 0.0 112.354 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -121.02 -40.71 2.59 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.312 1.445 . . . . 0.0 114.195 -172.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.7 t -132.38 71.26 79.47 Favored Pre-proline 0 N--CA 1.482 1.166 0 C-N-CA 124.429 1.092 . . . . 0.0 111.259 -177.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.51 139.46 49.12 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.302 2.668 . . . . 0.0 112.676 175.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.2 t -100.62 73.69 1.63 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.934 1.694 . . . . 0.0 111.815 -166.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -103.11 13.52 33.92 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 -172.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt -89.03 59.9 5.2 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.402 1.481 . . . . 0.0 112.917 -164.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.6 t -133.17 6.21 3.87 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -171.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 167.81 38.9 0.02 OUTLIER Glycine 0 CA--C 1.533 1.215 0 O-C-N 121.002 -1.062 . . . . 0.0 114.706 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -76.1 -53.86 7.69 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 118.539 1.169 . . . . 0.0 113.112 -172.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 mp -126.03 112.35 15.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.507 2.323 . . . . 0.0 109.996 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -92.3 -81.94 0.33 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.998 1.319 . . . . 0.0 111.552 173.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -159.07 -29.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.66 -170.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -82.4 -31.63 29.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.204 0.602 . . . . 0.0 111.5 170.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.86 -41.66 82.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.232 -0.918 . . . . 0.0 112.288 -175.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -69.46 -26.4 64.56 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.882 -1.136 . . . . 0.0 113.116 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -69.03 -3.6 13.71 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 166.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.1 mt -100.88 -54.56 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.788 1.235 . . . . 0.0 109.82 164.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.71 -56.7 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 119.398 0.999 . . . . 0.0 112.797 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.08 -30.45 70.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.577 -0.702 . . . . 0.0 111.338 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.55 -46.1 91.45 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 167.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -36.49 82.74 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.519 1.054 . . . . 0.0 111.826 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -24.81 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 O-C-N 120.7 -1.25 . . . . 0.0 112.009 172.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -79.9 -16.2 55.82 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 171.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.96 -50.89 5.11 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.695 -1.253 . . . . 0.0 112.002 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.7 m -124.49 -12.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -167.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 122.62 -74.82 0.37 Allowed Glycine 0 N--CA 1.468 0.831 0 C-N-CA 125.546 1.546 . . . . 0.0 112.602 164.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.5 tp -166.84 -41.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.332 1.453 . . . . 0.0 112.244 175.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.0 m-80 -108.81 -6.25 15.91 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -166.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -93.74 -19.45 21.06 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.156 0.982 . . . . 0.0 113.09 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -65.93 162.48 19.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.861 1.264 . . . . 0.0 112.21 166.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -112.23 167.1 10.69 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.541 1.162 . . . . 0.0 111.876 172.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.54 -21.55 35.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.656 1.182 . . . . 0.0 112.81 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.4 m -63.88 -48.68 75.71 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.489 1.516 . . . . 0.0 111.394 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -65.12 -43.04 93.27 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.088 -1.007 . . . . 0.0 111.956 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -56.96 -54.53 45.65 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.784 0.834 . . . . 0.0 112.067 171.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -63.61 -21.83 66.57 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt -79.21 -44.8 21.12 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.837 1.255 . . . . 0.0 112.094 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -80.34 -36.55 34.02 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.65 1.18 . . . . 0.0 113.401 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 mt -87.64 -20.83 25.79 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.385 1.474 . . . . 0.0 113.167 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.85 61.25 1.96 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.27 1.428 . . . . 0.0 111.94 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -123.56 169.31 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 127.052 2.141 . . . . 0.0 110.557 174.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -65.57 138.53 58.1 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.832 1.253 . . . . 0.0 109.605 164.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 13.3 t -57.54 -38.06 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 123.407 0.683 . . . . 0.0 111.496 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -72.05 -25.93 61.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.82 -36.53 75.68 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.568 -0.729 . . . . 0.0 110.676 169.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.13 71.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.852 0.751 . . . . 0.0 110.904 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -53.59 -41.01 66.14 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.292 1.437 . . . . 0.0 112.705 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -87.63 -33.34 18.86 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -63.29 -36.16 82.74 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.809 -1.182 . . . . 0.0 112.68 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.85 -45.38 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.847 1.259 . . . . 0.0 111.448 174.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -90.74 -27.7 18.76 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -71.93 -28.2 63.32 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 120.158 1.345 . . . . 0.0 112.805 176.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.8 t -85.04 -45.46 12.1 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.011 0.924 . . . . 0.0 113.308 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -96.7 -38.58 9.86 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -173.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 45.09 46.07 9.33 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 127.846 2.458 . . . . 0.0 113.844 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.3 mmt 60.67 -27.17 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 129.076 2.951 . . . . 0.0 116.768 -173.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.03 32.98 0.08 OUTLIER Glycine 0 CA--C 1.534 1.228 0 C-N-CA 125.839 1.685 . . . . 0.0 113.477 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 52.11 77.85 0.14 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.825 2.45 . . . . 0.0 113.94 -169.127 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.8 p 55.48 31.76 17.63 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.493 1.917 . . . . 0.0 114.349 168.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.45 -13.82 61.95 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.756 2.022 . . . . 0.0 112.496 -173.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -60.35 -19.9 57.37 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.764 2.826 . . . . 0.0 112.874 174.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.79 18.93 0.15 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.294 1.837 . . . . 0.0 115.443 -176.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -81.78 -4.35 56.15 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -142.87 -49.09 0.34 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.108 1.763 . . . . 0.0 110.256 -167.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.9 pt -70.89 161.15 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.694 1.198 . . . . 0.0 112.22 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.29 -9.02 0.13 Allowed 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 127.202 2.201 . . . . 0.0 116.389 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 39.6 mtm -89.04 -36.44 15.79 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.871 1.214 . . . . 0.0 113.462 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -86.83 -19.11 29.44 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -76.75 146.38 37.99 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.581 1.153 . . . . 0.0 111.512 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -145.0 133.85 22.38 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.488 1.115 . . . . 0.0 111.672 -176.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -92.22 137.54 32.28 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.383 1.073 . . . . 0.0 111.7 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.2 t -121.03 -48.89 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.469 1.108 . . . . 0.0 111.039 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 60.0 p -112.79 1.26 15.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.61 1.564 . . . . 0.0 113.963 176.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.9 m -119.21 5.38 11.24 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.868 1.667 . . . . 0.0 114.619 -171.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.57 130.62 39.11 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.33 -0.856 . . . . 0.0 112.014 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.7 m -141.18 129.55 22.42 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.48 1.512 . . . . 0.0 110.278 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 57.32 14.92 2.35 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -86.13 148.26 47.19 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.779 1.231 . . . . 0.0 111.826 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -79.15 52.01 4.1 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.455 3.436 . . . . 0.0 111.722 173.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -128.45 71.15 1.38 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.015 1.726 . . . . 0.0 110.839 -170.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 8.1 mp -114.47 88.87 16.58 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.348 1.459 . . . . 0.0 109.515 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo . . . . . 0 C--O 1.253 1.272 0 C-N-CA 123.862 3.041 . . . . 0.0 113.218 -179.779 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.709 0 N-CA-C 111.999 -0.441 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 4.5 t 57.74 -171.07 0.1 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.567 1.547 . . . . 0.0 113.771 -172.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -134.57 127.33 31.07 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.724 1.609 . . . . 0.0 110.172 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 66.0 mtt -133.63 92.27 2.96 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.845 1.258 . . . . 0.0 110.3 -175.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.58 97.85 2.3 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.538 1.135 . . . . 0.0 110.854 178.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 22.7 m -124.04 -2.15 8.21 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -175.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -146.91 1.96 0.78 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 115.03 1.492 . . . . 0.0 115.03 -176.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -121.52 8.7 10.15 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.203 1.801 . . . . 0.0 111.869 171.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.47 49.05 1.1 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.065 1.746 . . . . 0.0 110.79 -165.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -140.9 149.86 42.46 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.09 1.756 . . . . 0.0 111.523 171.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -153.05 -52.33 0.1 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.428 1.091 . . . . 0.0 112.267 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -135.8 72.37 1.44 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.685 1.594 . . . . 0.0 109.447 -177.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.7 mm -115.76 119.17 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.568 1.547 . . . . 0.0 109.626 -173.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 41.8 mt -139.81 103.13 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.943 1.297 . . . . 0.0 109.803 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -131.3 106.47 8.31 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.679 1.592 . . . . 0.0 109.495 174.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -156.12 148.98 24.08 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.296 1.438 . . . . 0.0 110.759 -176.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.274 39.1 pt 43.91 60.67 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 126.988 2.115 . . . . 0.0 114.634 176.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -92.76 -88.18 0.22 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.167 1.387 . . . . 0.0 111.191 -172.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -150.96 28.36 0.68 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 126.728 2.011 . . . . 0.0 111.726 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -86.37 122.09 29.86 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.536 1.134 . . . . 0.0 110.812 -177.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.14 -71.75 0.4 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.655 1.582 . . . . 0.0 112.079 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.0 mt -124.35 -1.1 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.966 1.307 . . . . 0.0 113.375 -168.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -67.22 -21.82 65.74 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.032 -1.042 . . . . 0.0 113.035 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.0 p -80.82 -32.65 35.13 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -173.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -101.44 -13.35 17.99 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.0 t -85.19 -36.81 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.956 0.903 . . . . 0.0 111.36 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.4 t -106.7 80.56 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 124.946 1.298 . . . . 0.0 109.768 -177.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.4 tp -120.84 152.42 38.41 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.699 1.6 . . . . 0.0 111.65 -178.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -129.93 25.48 5.28 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.541 1.536 . . . . 0.0 114.24 -174.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -131.79 61.29 57.42 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.61 1.164 . . . . 0.0 113.332 173.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -80.52 67.61 8.58 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.519 2.813 . . . . 0.0 112.014 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 94.4 mtt-85 -122.25 -64.59 1.19 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.004 1.321 . . . . 0.0 113.325 -173.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -158.02 126.75 2.99 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 125.324 1.45 . . . . 0.0 111.059 -178.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -83.17 140.68 9.98 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.8 3.0 . . . . 0.0 111.332 168.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.1 t -130.29 72.0 1.48 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 122.848 1.309 . . . . 0.0 111.754 -176.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -122.31 17.5 10.64 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.391 1.477 . . . . 0.0 114.045 -174.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.53 41.85 1.06 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.433 1.893 . . . . 0.0 111.822 -174.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.2 t -138.1 7.81 2.69 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.883 1.273 . . . . 0.0 114.184 -169.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.16 -56.78 7.5 Favored Glycine 0 CA--C 1.536 1.4 0 O-C-N 120.805 -1.185 . . . . 0.0 114.467 -170.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -92.68 -33.94 14.16 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -177.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.95 142.29 30.66 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.202 2.201 . . . . 0.0 108.997 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -116.37 -72.54 0.69 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.439 1.896 . . . . 0.0 111.84 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.84 -45.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.975 0.51 . . . . 0.0 111.158 -172.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -63.48 -30.65 71.74 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.467 0.707 . . . . 0.0 110.941 174.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -69.14 -35.4 76.32 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 111.842 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -70.54 -35.66 73.26 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.394 -0.816 . . . . 0.0 112.167 170.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -62.61 -7.43 4.74 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 170.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.3 mt -102.98 -55.43 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 125.581 1.552 . . . . 0.0 110.609 170.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 39.3 t -83.9 -55.2 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -172.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.02 -30.04 70.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.874 0.761 . . . . 0.0 112.189 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.17 -38.36 79.59 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.216 0.606 . . . . 0.0 112.431 167.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.82 -36.82 78.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.263 1.025 . . . . 0.0 111.694 173.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.79 -26.66 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 120.851 -1.156 . . . . 0.0 111.555 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -81.0 -8.73 59.84 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 171.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -98.78 -57.84 2.09 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.477 1.489 . . . . 0.0 112.33 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.6 m -118.0 -18.32 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 -164.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.98 -92.27 0.27 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.73 1.634 . . . . 0.0 110.468 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -166.82 -29.41 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.197 1.799 . . . . 0.0 112.976 173.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -99.36 -14.58 19.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.399 1.48 . . . . 0.0 114.133 -176.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -93.87 -14.99 25.47 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.216 1.006 . . . . 0.0 113.413 -175.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.85 166.29 21.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.639 1.576 . . . . 0.0 114.0 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -108.88 115.63 30.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.621 1.169 . . . . 0.0 111.189 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.36 63.27 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.002 1.321 . . . . 0.0 113.775 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.9 m -65.89 -40.01 91.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.102 0.961 . . . . 0.0 111.939 175.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -66.33 -37.41 85.31 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.437 -1.414 . . . . 0.0 112.244 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.68 -50.12 73.78 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.169 0.587 . . . . 0.0 110.817 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.6 p -69.9 -29.66 66.9 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -66.19 -36.59 83.49 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.321 1.449 . . . . 0.0 112.974 173.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.4 mmt-85 -92.83 -39.29 11.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.672 1.189 . . . . 0.0 113.535 -176.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 tt -80.82 -20.2 42.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.628 1.171 . . . . 0.0 111.976 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.24 65.79 0.49 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.67 1.988 . . . . 0.0 112.403 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.6 pt -132.65 -178.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 128.118 2.567 . . . . 0.0 109.295 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -81.53 156.13 25.41 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.361 -0.837 . . . . 0.0 111.052 165.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -58.51 -39.37 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.163 0.985 . . . . 0.0 111.241 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -69.76 -26.47 64.32 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.83 -40.42 87.98 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.701 0.682 . . . . 0.0 111.186 168.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.82 -48.68 65.56 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.349 0.522 . . . . 0.0 109.903 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -53.57 -39.06 64.48 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.433 1.493 . . . . 0.0 112.707 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -84.65 -41.77 16.0 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.851 0.75 . . . . 0.0 112.509 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.59 -35.98 77.44 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.14 -0.975 . . . . 0.0 113.129 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.2 mt -47.62 -51.65 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.297 1.439 . . . . 0.0 111.342 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -85.35 -33.46 22.04 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.73 -29.48 68.72 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -176.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.9 t -85.06 -41.64 15.57 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.672 1.189 . . . . 0.0 113.532 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -142.46 48.19 1.56 Allowed 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -167.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -54.98 -40.25 69.87 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.767 1.227 . . . . 0.0 113.709 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 64.1 mtt -86.53 -25.24 25.16 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.714 1.206 . . . . 0.0 113.107 -177.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.4 -14.34 64.07 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 125.413 1.483 . . . . 0.0 114.878 175.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -118.52 23.21 11.65 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.341 1.857 . . . . 0.0 112.866 170.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m 48.65 38.58 11.69 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 127.237 2.215 . . . . 0.0 113.109 177.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 57.11 5.61 0.27 Allowed 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 -174.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -3.06 50.75 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 119.749 -1.844 . . . . 0.0 114.186 -170.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -70.06 12.76 0.19 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.934 2.094 . . . . 0.0 115.077 -176.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -86.04 -15.42 41.38 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.873 1.669 . . . . 0.0 113.883 -173.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.5 m -123.37 -42.88 2.21 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.167 1.787 . . . . 0.0 110.857 -171.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -72.33 166.61 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 124.612 1.165 . . . . 0.0 108.783 167.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? 67.58 -8.31 0.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.996 2.119 . . . . 0.0 116.138 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.26 -10.4 8.96 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -114.9 -14.91 11.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -161.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -89.81 7.46 36.91 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.963 1.305 . . . . 0.0 114.116 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -95.51 154.97 16.94 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.871 1.668 . . . . 0.0 113.369 -172.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -76.16 145.86 39.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.113 0.965 . . . . 0.0 111.8 171.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.4 t -131.75 -47.51 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 124.269 1.028 . . . . 0.0 112.218 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.4 m -116.07 3.27 13.55 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.794 1.238 . . . . 0.0 113.315 -177.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.2 m -94.32 -5.27 47.0 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.246 1.418 . . . . 0.0 114.465 -169.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -83.62 139.86 32.56 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.952 1.301 . . . . 0.0 112.665 -176.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 72.1 m -147.43 146.34 29.53 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.642 1.577 . . . . 0.0 110.968 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 55.04 19.37 2.71 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.071 1.748 . . . . 0.0 115.717 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 51.4 mm-40 -73.84 150.35 88.34 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.529 1.131 . . . . 0.0 111.878 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -79.91 64.14 8.82 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 124.375 3.384 . . . . 0.0 111.669 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 52.67 43.21 31.53 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.865 1.666 . . . . 0.0 112.207 -171.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.2 tp -123.6 89.42 51.29 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.446 1.498 . . . . 0.0 110.639 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 C--O 1.252 1.195 0 C-N-CA 123.732 2.954 . . . . 0.0 113.075 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.511 0 N-CA-C 111.029 -0.829 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.0 m -137.46 132.77 33.83 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.092 1.357 . . . . 0.0 111.424 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -153.91 117.37 4.62 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.659 1.183 . . . . 0.0 110.754 -178.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 1.7 mmt -135.95 67.34 1.47 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.301 1.44 . . . . 0.0 111.765 -175.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -114.68 -12.82 12.14 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 62.9 m -55.97 -29.34 60.08 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.722 2.009 . . . . 0.0 115.033 -173.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.0 mtm -87.17 -12.53 46.66 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.014 1.326 . . . . 0.0 114.002 -172.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -112.66 -26.93 8.38 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.305 1.842 . . . . 0.0 111.952 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -70.5 -31.06 68.01 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.007 1.723 . . . . 0.0 113.06 175.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.7 mt -103.57 168.83 8.9 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.956 1.302 . . . . 0.0 112.622 -172.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 59.02 19.86 7.66 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 126.567 1.947 . . . . 0.0 115.332 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -92.92 23.42 4.23 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.166 1.787 . . . . 0.0 114.205 -177.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.3 mm -61.91 -32.03 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.721 1.208 . . . . 0.0 113.25 -165.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.2 mt -125.98 65.79 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 125.163 1.385 . . . . 0.0 109.549 -178.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -126.95 -26.57 3.14 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -152.6 -60.14 0.15 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.266 0.939 . . . . 0.0 113.529 -175.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.282 0.5 OUTLIER 62.43 124.33 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 130.243 3.417 . . . . 0.0 114.072 -176.324 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -131.92 35.89 3.72 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.19 1.396 . . . . 0.0 112.256 -177.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -63.08 -21.39 66.14 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.607 0.763 . . . . 0.0 111.49 160.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -148.04 141.18 25.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.906 1.682 . . . . 0.0 112.344 174.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.6 -88.06 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.92 1.688 . . . . 0.0 111.442 176.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 88.0 mt -131.4 10.81 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 126.857 2.063 . . . . 0.0 111.229 -168.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -91.26 -1.11 57.75 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.194 -1.566 . . . . 0.0 114.028 -172.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.3 t -118.23 -50.02 2.47 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.648 1.179 . . . . 0.0 112.717 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -61.42 -28.45 69.27 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.5 t -85.38 -27.16 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.455 1.502 . . . . 0.0 112.035 175.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.0 t -110.99 60.57 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.751 1.621 . . . . 0.0 110.194 -174.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.1 mt -135.84 178.3 7.16 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.633 1.973 . . . . 0.0 111.404 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt 59.07 47.04 12.5 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.815 1.646 . . . . 0.0 113.54 -177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 t30 48.93 65.88 6.49 Favored Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 126.568 1.947 . . . . 0.0 113.247 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -78.79 77.41 4.08 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 124.025 3.15 . . . . 0.0 112.066 -169.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -129.42 -52.6 1.18 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.832 1.253 . . . . 0.0 114.089 -176.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.7 t 34.67 76.55 0.42 Allowed Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 127.871 2.469 . . . . 0.0 113.103 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -64.03 162.4 29.51 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.418 2.078 . . . . 0.0 113.462 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.2 p -117.17 55.81 0.83 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.015 1.726 . . . . 0.0 112.943 -161.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -76.38 27.38 0.12 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.151 1.538 . . . . 0.0 115.151 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 24.75 1.48 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.808 2.043 . . . . 0.0 113.326 -175.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 62.48 -2.96 0.31 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 129.804 3.242 . . . . 0.0 116.7 174.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.29 -36.47 12.59 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 123.736 0.684 . . . . 0.0 113.756 -165.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -87.56 -45.97 9.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.686 0.794 . . . . 0.0 111.668 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp -121.32 117.63 27.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 128.026 2.53 . . . . 0.0 109.287 173.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -105.21 -70.82 0.76 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 110.995 168.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -163.82 -43.34 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.715 0.806 . . . . 0.0 110.715 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.8 10.82 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.278 1.431 . . . . 0.0 112.799 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -111.89 -46.95 3.18 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.793 1.237 . . . . 0.0 112.482 175.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -67.44 -25.67 66.02 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.746 -1.221 . . . . 0.0 112.641 175.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -65.88 -10.63 40.16 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.491 1.517 . . . . 0.0 113.713 168.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.43 -57.01 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 125.158 1.383 . . . . 0.0 110.226 165.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.2 t -71.27 -49.45 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.064 1.302 . . . . 0.0 112.955 -168.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.1 87.33 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.757 0.708 . . . . 0.0 110.98 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.89 -38.54 82.56 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.21 -34.57 63.76 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.928 0.891 . . . . 0.0 112.346 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.99 -36.04 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.227 -0.921 . . . . 0.0 111.239 170.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.9 m -73.42 -13.41 61.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 172.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -100.8 -40.41 7.33 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.767 1.167 . . . . 0.0 112.323 -172.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.8 m -134.62 -22.47 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -175.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 93.71 135.62 7.66 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 119.619 1.099 . . . . 0.0 111.772 -172.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.15 -25.02 1.3 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 128.167 2.587 . . . . 0.0 114.869 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -89.05 -14.86 35.42 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.158 1.383 . . . . 0.0 113.66 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -114.66 -21.53 10.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.863 1.265 . . . . 0.0 113.47 -172.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.2 169.99 11.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.626 1.171 . . . . 0.0 112.738 171.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p30 -113.25 168.95 9.3 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.036 0.922 . . . . 0.0 111.387 169.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.03 -23.45 35.9 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.217 1.007 . . . . 0.0 112.702 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 m -61.53 -44.62 96.72 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.941 1.696 . . . . 0.0 112.254 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -65.7 -34.04 77.28 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.652 -1.28 . . . . 0.0 112.763 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.54 -51.43 50.89 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.514 0.597 . . . . 0.0 111.483 172.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.4 p -61.98 -18.15 59.44 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -84.19 -32.28 24.66 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.82 1.248 . . . . 0.0 112.826 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -102.69 -36.08 8.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.016 1.326 . . . . 0.0 113.205 -175.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.16 -16.2 41.2 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.679 1.192 . . . . 0.0 113.197 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.25 47.63 13.87 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-O 122.78 1.276 . . . . 0.0 111.628 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.7 pt -110.82 160.0 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 127.969 2.507 . . . . 0.0 109.795 175.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.2 t -68.25 152.04 46.05 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.496 -0.753 . . . . 0.0 110.809 167.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.8 t -58.09 -36.67 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.001 0.92 . . . . 0.0 111.287 -176.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -69.53 -32.25 70.96 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -67.91 -38.87 83.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.787 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.27 -48.79 71.97 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.628 0.649 . . . . 0.0 110.471 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -54.57 -42.34 70.89 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.469 1.507 . . . . 0.0 112.746 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -87.43 -33.37 19.1 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -64.39 -37.33 87.12 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.802 0.841 . . . . 0.0 112.395 177.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.2 mt -48.03 -50.68 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.49 1.116 . . . . 0.0 111.02 174.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -84.64 -30.31 25.0 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -75.85 -24.63 55.77 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.769 1.168 . . . . 0.0 113.391 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.2 t -90.09 -32.84 16.52 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.246 1.018 . . . . 0.0 113.47 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -151.78 62.65 0.86 Allowed 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -176.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 54.3 ttt-85 -56.03 -39.06 71.39 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 64.4 mtt -136.92 -37.15 0.66 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.649 1.58 . . . . 0.0 112.431 175.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.16 95.82 0.1 Allowed Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.317 0.961 . . . . 0.0 112.487 175.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 47.24 33.89 2.8 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 126.505 1.922 . . . . 0.0 113.9 -178.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m 47.33 33.79 2.85 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.935 2.094 . . . . 0.0 112.825 -174.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 54.8 31.19 15.08 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.788 2.035 . . . . 0.0 113.955 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -90.65 -10.82 41.8 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -175.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -76.01 9.83 2.23 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.186 1.794 . . . . 0.0 115.611 -162.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -11.05 58.77 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.421 1.888 . . . . 0.0 114.461 -177.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 89.5 m -138.15 -41.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.59 1.556 . . . . 0.0 111.012 -162.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.7 pt -68.03 171.57 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.786 0.834 . . . . 0.0 111.349 171.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? 66.76 -20.18 0.11 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 127.033 2.133 . . . . 0.0 116.054 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 -9.71 11.18 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -111.7 -28.81 7.95 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 -166.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -83.93 154.72 23.22 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.492 1.117 . . . . 0.0 112.315 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -94.49 145.68 24.63 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.844 1.258 . . . . 0.0 112.021 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -118.1 142.54 47.31 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.16 1.384 . . . . 0.0 112.239 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.9 t -122.69 -45.43 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.791 1.236 . . . . 0.0 111.471 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.1 m -121.51 15.2 11.17 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.122 1.369 . . . . 0.0 113.532 -178.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t -141.03 28.34 1.91 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.578 1.551 . . . . 0.0 113.382 -175.44 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -90.86 154.58 19.39 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.751 1.221 . . . . 0.0 112.51 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.7 m -137.76 176.88 8.31 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.96 1.704 . . . . 0.0 110.719 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.71 -15.76 54.29 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -144.05 154.96 58.76 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.985 2.114 . . . . 0.0 111.706 168.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -81.68 56.38 5.9 Favored 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 124.434 3.423 . . . . 0.0 112.258 -177.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -130.94 71.04 1.46 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.395 1.478 . . . . 0.0 110.878 -177.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.3 tp -143.06 135.65 13.53 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.875 1.67 . . . . 0.0 109.754 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 C--O 1.25 1.107 0 C-N-CA 123.32 2.68 . . . . 0.0 112.742 -179.942 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.145 -0.382 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 8.3 t -147.48 157.76 43.71 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.201 1.4 . . . . 0.0 111.604 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -148.1 121.09 8.8 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.912 1.285 . . . . 0.0 111.074 178.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 94.3 mtp -138.02 35.64 2.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.02 1.328 . . . . 0.0 112.789 -177.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -76.77 -61.14 2.07 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.612 0.765 . . . . 0.0 112.392 -177.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 17.8 m 48.64 29.46 2.16 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 127.381 2.272 . . . . 0.0 117.132 171.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.2 mtt -150.33 -40.1 0.13 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.296 1.438 . . . . 0.0 113.355 -177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -88.32 -4.35 58.7 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.037 1.335 . . . . 0.0 112.919 -174.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.06 20.36 1.6 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.009 1.324 . . . . 0.0 113.021 -162.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mp -138.86 145.25 39.77 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.597 1.159 . . . . 0.0 112.069 174.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -147.01 -20.33 0.4 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.509 1.924 . . . . 0.0 113.016 176.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -81.12 39.61 0.51 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.294 2.238 . . . . 0.0 114.009 -173.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.1 mt -104.1 113.89 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 125.537 1.535 . . . . 0.0 109.452 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.5 mp -130.93 -53.1 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 125.057 1.343 . . . . 0.0 110.388 177.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -127.77 118.6 24.05 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.149 1.38 . . . . 0.0 110.144 174.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -155.59 -171.69 3.87 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.545 1.538 . . . . 0.0 110.47 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.7 tt -124.68 126.3 71.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 127.271 2.228 . . . . 0.0 109.513 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -153.92 178.46 9.9 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.989 2.116 . . . . 0.0 111.883 -173.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -75.1 68.33 1.87 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.494 1.518 . . . . 0.0 112.047 177.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -90.56 24.84 2.49 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.433 1.893 . . . . 0.0 114.791 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.63 -70.16 0.23 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.166 1.786 . . . . 0.0 113.647 -176.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 92.9 mt -131.67 9.72 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.837 1.655 . . . . 0.0 111.229 -171.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -90.51 -5.13 56.38 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.446 -1.409 . . . . 0.0 113.5 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.3 p -113.17 -55.04 2.57 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.466 1.506 . . . . 0.0 112.604 -173.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.1 p-10 -58.87 -24.71 62.53 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.201 1.801 . . . . 0.0 114.965 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t -84.85 -20.27 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 126.04 1.736 . . . . 0.0 112.25 175.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.7 t -128.96 61.84 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 125.636 1.574 . . . . 0.0 110.31 -171.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.2 mt -136.57 163.25 30.98 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.798 1.639 . . . . 0.0 112.682 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -99.11 36.74 1.65 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.843 2.057 . . . . 0.0 112.483 -174.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 t30 50.83 60.93 14.14 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 126.662 1.985 . . . . 0.0 114.172 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -72.25 87.64 0.89 Allowed 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.702 2.935 . . . . 0.0 112.531 -175.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 -132.94 -58.3 0.91 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.379 1.472 . . . . 0.0 113.639 176.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.5 t 40.06 79.81 0.31 Allowed Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 127.679 2.392 . . . . 0.0 113.301 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.64 165.78 28.24 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 122.935 2.424 . . . . 0.0 113.982 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.2 p -117.71 59.15 0.79 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.745 1.618 . . . . 0.0 113.027 -157.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -98.99 18.49 17.13 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -171.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.68 19.55 0.14 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.165 2.186 . . . . 0.0 114.976 -170.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.3 t -147.13 2.17 0.77 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.397 1.879 . . . . 0.0 113.172 -171.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -93.37 -63.71 1.07 Allowed Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.848 1.213 . . . . 0.0 114.043 -174.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -82.94 -26.83 31.04 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -168.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp -139.51 134.75 32.68 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.63 1.572 . . . . 0.0 110.14 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -119.24 -68.12 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.428 1.891 . . . . 0.0 112.415 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -164.56 -39.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -173.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -67.84 -29.94 69.2 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.437 0.695 . . . . 0.0 110.714 171.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -75.2 -35.49 61.5 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.153 0.981 . . . . 0.0 111.909 -173.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -66.58 -36.64 83.11 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.244 -0.91 . . . . 0.0 112.874 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.49 -4.68 2.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 170.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mt -109.78 -52.6 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 125.415 1.486 . . . . 0.0 110.816 168.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.5 t -68.06 -63.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.738 0.815 . . . . 0.0 111.563 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.88 69.39 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.098 0.559 . . . . 0.0 111.583 -175.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -58.03 -37.23 73.95 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.62 -35.52 62.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.884 1.274 . . . . 0.0 111.789 173.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.17 -34.54 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.069 -1.644 . . . . 0.0 110.566 173.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -78.7 -1.97 37.04 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 169.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -101.28 -45.5 5.32 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 120.013 1.279 . . . . 0.0 112.55 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.95 -12.37 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.4 -78.51 0.36 Allowed Glycine 0 N--CA 1.469 0.845 0 C-N-CA 125.161 1.363 . . . . 0.0 111.971 166.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.5 tt -161.19 -48.92 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.762 1.225 . . . . 0.0 112.066 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -95.71 -17.93 20.88 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.202 1.801 . . . . 0.0 114.391 -171.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -85.73 -14.29 45.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -167.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 170.77 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.656 1.583 . . . . 0.0 112.761 168.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -124.42 166.22 16.36 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.558 1.17 . . . . 0.0 112.659 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.54 -28.62 56.37 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.134 1.374 . . . . 0.0 112.551 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -64.44 -46.05 84.86 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.388 1.475 . . . . 0.0 112.039 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -61.44 -50.87 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.628 0.771 . . . . 0.0 111.597 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.0 mt -54.51 -42.32 70.68 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.563 -0.711 . . . . 0.0 111.63 176.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 m -60.84 -28.65 68.99 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.209 1.403 . . . . 0.0 113.876 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -85.92 -31.44 22.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.237 1.415 . . . . 0.0 112.588 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -96.68 -33.54 11.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.448 1.099 . . . . 0.0 113.009 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.9 mt -89.8 -17.1 28.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.925 1.29 . . . . 0.0 113.479 175.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.54 54.33 3.08 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 122.843 1.306 . . . . 0.0 112.684 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.2 pt -119.26 164.96 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 126.923 2.089 . . . . 0.0 110.379 175.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 8.9 t -74.28 147.99 41.84 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 121.796 -0.565 . . . . 0.0 110.866 166.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.3 t -54.49 -30.66 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.134 1.374 . . . . 0.0 111.08 176.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.55 -27.04 61.13 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 4.1 mtmp? -81.33 -32.71 32.89 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.361 0.982 . . . . 0.0 111.15 167.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.42 74.51 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.969 0.804 . . . . 0.0 111.462 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -68.16 -25.96 65.52 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -94.4 -33.39 13.17 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -57.56 -44.22 85.11 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.214 -0.929 . . . . 0.0 111.852 175.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.8 mt -47.3 -60.72 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.989 1.316 . . . . 0.0 110.631 176.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -77.21 -18.65 57.55 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -175.027 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -82.72 -35.89 26.28 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.583 1.083 . . . . 0.0 112.648 174.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 67.9 m -95.72 -19.22 19.85 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -175.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -145.4 66.24 1.23 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.557 1.143 . . . . 0.0 112.528 173.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -67.71 -47.17 70.12 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 121.198 -0.939 . . . . 0.0 113.399 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 64.6 mtt -116.39 -31.71 5.51 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.014 1.326 . . . . 0.0 112.973 -175.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.37 -66.39 0.04 OUTLIER Glycine 0 N--CA 1.469 0.875 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 173.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -121.2 -97.04 0.46 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.087 1.355 . . . . 0.0 109.102 162.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.7 p -140.33 30.7 1.94 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.053 1.341 . . . . 0.0 113.535 -165.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.9 m120 60.94 16.65 7.13 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -76.76 -8.71 57.81 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.643 -1.286 . . . . 0.0 114.196 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -70.38 13.45 0.17 Allowed 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 125.815 1.646 . . . . 0.0 114.262 176.033 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -85.67 -12.54 51.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.601 2.36 . . . . 0.0 112.878 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 36.3 m -130.42 -42.6 1.18 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.204 1.802 . . . . 0.0 111.269 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.2 mt -71.46 156.45 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.312 1.045 . . . . 0.0 108.34 166.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 65.01 -6.1 0.36 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 117.368 2.358 . . . . 0.0 117.368 171.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -83.6 -28.91 28.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.486 1.039 . . . . 0.0 113.391 175.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -108.62 -14.87 14.54 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.901 1.281 . . . . 0.0 113.43 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -90.6 163.76 14.44 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.239 1.815 . . . . 0.0 112.501 -174.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.9 t70 56.63 -152.04 0.4 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 125.099 1.36 . . . . 0.0 112.73 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -75.54 126.77 31.66 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.367 -1.458 . . . . 0.0 111.412 174.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.2 t -124.9 -41.74 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 124.642 1.177 . . . . 0.0 112.183 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.5 t -130.37 33.42 4.31 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.9 1.28 . . . . 0.0 112.544 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t 54.09 43.9 30.03 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.613 1.565 . . . . 0.0 113.753 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.45 171.58 13.98 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.266 1.427 . . . . 0.0 113.432 -177.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.0 m -146.66 137.07 23.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.788 1.635 . . . . 0.0 109.83 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 51.86 37.22 20.15 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.488 1.115 . . . . 0.0 113.707 -173.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -121.24 82.0 37.78 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 125.814 1.645 . . . . 0.0 111.941 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.0 96.64 0.95 Allowed 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 123.778 2.985 . . . . 0.0 111.464 178.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -103.01 59.91 0.77 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.415 1.486 . . . . 0.0 111.556 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 tt -134.75 72.94 68.19 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.69 1.196 . . . . 0.0 110.91 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo . . . . . 0 C--O 1.253 1.231 0 C-N-CA 124.016 3.144 . . . . 0.0 113.368 176.417 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.546 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 53.0 m -131.5 142.25 49.92 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.303 1.441 . . . . 0.0 111.49 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -147.32 115.33 6.52 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.285 1.034 . . . . 0.0 110.36 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 61.5 mtt -137.17 67.35 1.44 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.313 1.445 . . . . 0.0 110.829 -177.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -135.46 -48.47 0.71 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.53 1.132 . . . . 0.0 113.079 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 13.4 t 63.69 -52.04 0.24 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 128.747 2.819 . . . . 0.0 115.609 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.4 mtt -87.03 -19.32 28.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.72 1.208 . . . . 0.0 114.138 -169.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -93.04 1.12 57.42 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.003 1.721 . . . . 0.0 113.473 -174.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.8 pp0? -127.28 28.22 5.76 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.588 1.555 . . . . 0.0 113.927 -171.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.6 mt -103.52 -63.83 1.15 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.829 1.252 . . . . 0.0 112.89 -174.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -136.48 -1.34 2.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.687 1.195 . . . . 0.0 114.021 -174.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -98.69 78.55 2.36 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.495 1.118 . . . . 0.0 112.318 -176.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 mp -128.19 77.71 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 123.804 0.842 . . . . 0.0 110.199 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.8 mt -135.03 140.32 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 126.465 1.906 . . . . 0.0 109.063 -176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 57.64 -178.0 0.06 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.222 1.809 . . . . 0.0 114.313 -172.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -119.82 145.66 46.43 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.497 1.519 . . . . 0.0 112.091 -174.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.4 pt -115.15 41.26 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.969 1.708 . . . . 0.0 113.359 -164.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.02 170.44 16.59 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.431 1.492 . . . . 0.0 112.48 178.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -73.75 54.7 0.5 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 126.159 1.784 . . . . 0.0 113.148 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -131.15 134.19 46.29 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.578 1.551 . . . . 0.0 111.383 175.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -146.09 -80.11 0.16 Allowed 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.894 1.278 . . . . 0.0 112.125 172.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.1 mt -125.09 7.18 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 125.606 1.563 . . . . 0.0 111.987 -172.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -90.23 -4.23 57.34 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.539 -1.35 . . . . 0.0 113.583 -177.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.3 p -112.61 -59.17 2.05 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.545 1.538 . . . . 0.0 111.826 -174.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -57.75 -25.43 60.43 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.328 1.851 . . . . 0.0 115.313 178.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 85.9 t -87.86 -21.47 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 125.941 1.696 . . . . 0.0 112.001 176.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.7 t -126.76 61.09 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.885 1.674 . . . . 0.0 110.252 -170.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.0 mt -106.57 154.8 20.37 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.835 1.654 . . . . 0.0 112.383 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -119.42 34.93 5.02 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.797 1.639 . . . . 0.0 113.03 -173.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 t30 50.21 68.28 3.58 Favored Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 126.994 2.118 . . . . 0.0 113.566 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.43 83.12 1.94 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.779 2.986 . . . . 0.0 112.417 -174.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? 47.45 53.38 11.09 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 126.143 1.777 . . . . 0.0 112.907 176.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.4 t 52.35 88.99 0.11 Allowed Pre-proline 0 N--CA 1.479 1.011 0 C-N-CA 128.158 2.583 . . . . 0.0 112.617 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.06 163.3 36.43 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.914 2.409 . . . . 0.0 114.32 -177.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.4 p -115.07 64.92 0.68 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.347 1.859 . . . . 0.0 112.876 -161.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -83.82 48.42 1.44 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.566 1.147 . . . . 0.0 113.24 -175.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -75.48 54.48 0.75 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.953 2.101 . . . . 0.0 111.876 174.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.8 t -113.19 3.48 16.05 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.283 1.833 . . . . 0.0 113.898 -171.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.46 -24.73 71.05 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.904 1.24 . . . . 0.0 116.058 -167.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -124.22 5.75 8.48 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.63 1.172 . . . . 0.0 113.487 175.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.39 99.67 4.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.521 1.129 . . . . 0.0 113.218 -172.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.1 m -147.58 90.17 1.83 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.163 2.185 . . . . 0.0 111.322 -171.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.84 5.74 3.59 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 161.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -128.49 -38.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.719 1.207 . . . . 0.0 111.05 172.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -74.74 -32.95 62.26 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.149 1.38 . . . . 0.0 111.942 -173.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -67.9 -36.41 80.16 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.299 -0.875 . . . . 0.0 112.241 171.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -63.29 -4.98 2.92 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 170.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.2 mt -109.54 -15.8 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.052 1.741 . . . . 0.0 112.563 174.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.0 t -128.78 -55.86 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 119.316 0.962 . . . . 0.0 112.904 -172.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.73 -40.67 95.9 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.643 1.11 . . . . 0.0 111.124 173.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -66.49 -27.53 67.86 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 172.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.11 -38.48 56.86 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.303 1.041 . . . . 0.0 111.682 175.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.64 -34.28 54.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.826 -1.171 . . . . 0.0 110.642 169.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -72.44 -10.84 60.29 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -106.78 -42.35 4.97 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.423 1.465 . . . . 0.0 112.894 -173.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -127.18 -14.88 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -173.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.07 -79.67 0.35 Allowed Glycine 0 N--CA 1.468 0.768 0 C-N-CA 125.373 1.463 . . . . 0.0 112.044 165.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tt -164.05 -46.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.945 1.298 . . . . 0.0 112.042 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -98.79 -17.2 18.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.316 1.846 . . . . 0.0 114.531 -172.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -87.15 -14.5 41.07 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -68.78 165.98 18.51 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.342 1.457 . . . . 0.0 112.085 166.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -119.81 169.62 9.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.284 1.04 . . . . 0.0 111.831 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.66 -23.18 42.68 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.388 1.075 . . . . 0.0 112.824 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.3 m -67.41 -46.25 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.827 1.651 . . . . 0.0 112.15 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.16 -29.87 69.68 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 120.453 -1.405 . . . . 0.0 112.829 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.83 -54.56 18.1 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.429 1.091 . . . . 0.0 112.031 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.3 p -60.63 -30.17 69.7 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.732 0.813 . . . . 0.0 112.989 -177.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -69.34 -45.12 70.2 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.374 1.47 . . . . 0.0 113.388 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 75.8 mtt85 -95.6 -36.74 11.14 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.23 -15.65 46.09 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.431 1.493 . . . . 0.0 111.18 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.99 60.2 2.2 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.229 1.812 . . . . 0.0 112.155 175.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.0 pt -128.88 162.15 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 128.209 2.603 . . . . 0.0 109.408 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.8 t -68.29 151.5 46.82 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.499 -0.75 . . . . 0.0 110.666 167.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -58.7 -36.03 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.84 0.856 . . . . 0.0 111.007 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.43 -32.59 73.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 177.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 58.6 mttt -66.4 -37.52 85.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.6 -0.714 . . . . 0.0 111.064 170.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.83 62.19 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.791 0.723 . . . . 0.0 110.28 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -56.52 -35.28 67.9 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.845 1.658 . . . . 0.0 113.403 178.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -86.95 -43.03 12.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.933 0.788 . . . . 0.0 112.634 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.43 -37.58 78.45 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.735 1.152 . . . . 0.0 113.142 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -47.49 -57.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.544 1.137 . . . . 0.0 110.882 173.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.2 pttm -78.88 -35.13 44.15 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -65.74 -30.02 70.62 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.149 0.886 . . . . 0.0 112.739 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.4 t -78.19 -43.25 29.05 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.448 1.099 . . . . 0.0 112.708 171.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.09 84.15 1.45 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.524 1.13 . . . . 0.0 113.033 -175.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -63.14 -46.75 85.75 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.103 0.961 . . . . 0.0 112.97 175.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 17.0 mmt -116.41 -13.82 10.98 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 126.016 1.726 . . . . 0.0 113.662 -177.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 109.79 -50.77 0.75 Allowed Glycine 0 N--CA 1.473 1.124 0 C-N-CA 125.65 1.595 . . . . 0.0 112.632 176.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.1 mtp85 -111.53 30.92 6.53 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.586 1.554 . . . . 0.0 113.158 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.3 m 50.41 32.85 6.88 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.849 2.059 . . . . 0.0 113.295 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 55.98 9.93 0.52 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.71 2.004 . . . . 0.0 115.728 -172.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.36 10.05 37.68 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.316 1.446 . . . . 0.0 114.246 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.6 p90 -68.75 18.18 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 127.036 2.134 . . . . 0.0 114.717 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -76.97 -25.96 53.39 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.32 2.248 . . . . 0.0 111.474 -177.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 86.1 m -131.11 -42.98 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.892 2.077 . . . . 0.0 111.367 -169.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 mt -76.22 159.21 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.54 1.136 . . . . 0.0 108.859 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 66.93 -22.81 0.11 Allowed 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 127.559 2.344 . . . . 0.0 116.227 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -23.48 26.52 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.798 1.181 . . . . 0.0 114.079 -168.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -107.87 -11.09 15.42 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -92.15 5.78 49.07 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -171.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -84.58 47.34 1.35 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.679 1.592 . . . . 0.0 113.604 -170.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -73.61 139.83 45.77 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.455 1.102 . . . . 0.0 112.376 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 50.3 t -135.05 -51.52 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.723 1.209 . . . . 0.0 111.802 177.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 60.0 p -117.25 19.66 14.03 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.82 1.648 . . . . 0.0 113.634 -173.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.0 t 55.94 43.47 27.32 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.144 1.378 . . . . 0.0 112.754 -171.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -133.49 161.91 33.3 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.374 1.869 . . . . 0.0 111.679 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.1 t -128.94 167.69 17.07 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.274 1.43 . . . . 0.0 112.184 -177.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -78.55 31.09 0.19 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.638 1.975 . . . . 0.0 114.002 -175.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 49.57 66.57 5.46 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.072 2.149 . . . . 0.0 113.036 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -65.05 101.2 0.39 Allowed 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 124.108 3.205 . . . . 0.0 111.742 -177.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -145.77 47.22 1.26 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.78 1.632 . . . . 0.0 110.896 -175.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.5 tt -127.73 71.27 77.86 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 125.344 1.458 . . . . 0.0 110.312 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.258 0 C-N-CA 124.044 3.163 . . . . 0.0 113.141 179.589 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.551 0 N-CA-C 111.631 -0.587 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 79.0 p -145.83 160.71 41.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.463 1.505 . . . . 0.0 112.196 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -142.79 110.3 5.77 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.615 1.166 . . . . 0.0 110.876 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.5 mtt -142.79 59.06 1.43 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.49 1.516 . . . . 0.0 110.621 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -129.25 26.31 5.44 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.204 1.401 . . . . 0.0 113.79 -173.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 35.9 m -112.52 16.98 19.62 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -158.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ptm -150.77 -13.07 0.23 Allowed 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 -176.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -132.17 7.1 4.25 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.221 1.408 . . . . 0.0 112.851 -174.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.67 29.06 1.75 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.554 1.942 . . . . 0.0 110.781 -172.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -101.32 93.27 5.34 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.47 1.508 . . . . 0.0 110.052 -179.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -144.48 102.14 3.78 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.595 1.958 . . . . 0.0 107.176 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -74.75 145.62 42.86 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.268 0.627 . . . . 0.0 111.427 170.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -134.89 43.83 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.446 1.099 . . . . 0.0 110.914 -168.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.8 mt -111.18 95.43 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.529 1.532 . . . . 0.0 109.63 -173.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.6 mp0 -123.27 78.31 1.56 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.339 1.456 . . . . 0.0 110.454 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -134.23 9.45 3.77 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 20.7 pt -117.01 78.65 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.71 1.604 . . . . 0.0 111.981 -171.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -134.21 34.19 3.31 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.539 1.535 . . . . 0.0 113.946 -173.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt 53.35 41.89 32.08 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.771 1.629 . . . . 0.0 113.738 174.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.253 2.5 mt-10 58.41 26.95 14.77 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 174.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.35 12.61 0.43 Allowed 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -170.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.7 mp -115.15 7.1 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 127.092 2.157 . . . . 0.0 112.225 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -86.07 -10.19 55.38 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.386 -1.446 . . . . 0.0 114.184 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.8 t -114.42 -48.82 2.86 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.749 1.22 . . . . 0.0 112.449 -170.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -59.47 -22.3 61.33 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.7 p -107.52 -6.09 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.972 1.709 . . . . 0.0 113.344 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.0 t -133.5 57.4 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.828 1.651 . . . . 0.0 110.332 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.9 tp -115.51 140.55 49.05 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.966 1.306 . . . . 0.0 111.584 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -128.21 37.25 4.18 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.782 1.633 . . . . 0.0 113.02 -176.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.5 t30 49.02 65.84 6.55 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 126.37 1.868 . . . . 0.0 113.225 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -71.19 86.46 0.78 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 124.007 3.138 . . . . 0.0 112.566 -171.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -130.56 -42.23 1.17 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.021 1.728 . . . . 0.0 113.428 179.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 t -132.72 86.26 44.7 Favored Pre-proline 0 N--CA 1.48 1.035 0 C-N-CA 124.459 1.104 . . . . 0.0 110.859 -174.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.82 160.57 37.34 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.067 2.511 . . . . 0.0 112.718 173.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.8 p -77.29 60.26 1.94 Allowed 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.953 2.501 . . . . 0.0 113.558 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -84.92 18.7 2.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.366 1.867 . . . . 0.0 115.459 -172.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.29 51.96 2.14 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.944 1.698 . . . . 0.0 113.553 -159.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t -104.48 -10.78 17.43 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -168.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -90.85 -79.79 1.38 Allowed Glycine 0 CA--C 1.533 1.2 0 C-N-CA 125.514 1.53 . . . . 0.0 112.556 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 63.41 9.11 3.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.155 2.182 . . . . 0.0 116.587 176.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 mp -136.67 122.36 19.8 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.86 1.264 . . . . 0.0 109.782 164.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -129.17 -69.12 0.71 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.934 0.893 . . . . 0.0 112.551 -176.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -156.35 -20.35 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -166.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -93.04 -31.79 14.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.328 0.651 . . . . 0.0 111.465 168.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -79.25 -43.34 23.94 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.804 . . . . 0.0 112.626 -166.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -69.64 -23.47 63.49 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.26 -0.9 . . . . 0.0 112.533 174.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -68.61 -3.7 12.78 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 164.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -106.01 -50.37 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.173 1.389 . . . . 0.0 109.856 165.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 47.5 t -66.69 -62.2 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.417 1.008 . . . . 0.0 111.558 -174.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.75 64.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.907 -0.496 . . . . 0.0 111.944 -175.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -57.15 -39.57 75.49 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 167.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.68 -34.39 64.87 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.221 1.008 . . . . 0.0 112.075 175.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -62.52 -34.26 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 O-C-N 120.656 -1.278 . . . . 0.0 110.081 173.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.4 t -75.32 -10.33 59.37 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 170.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -99.22 -43.9 6.45 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.342 -1.474 . . . . 0.0 112.534 -173.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.4 m -132.51 -11.81 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -171.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.02 -77.73 0.39 Allowed Glycine 0 N--CA 1.471 0.993 0 C-N-CA 125.031 1.3 . . . . 0.0 112.478 165.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 tp -161.88 -44.0 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.763 1.225 . . . . 0.0 112.159 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -109.6 -8.35 14.99 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.299 1.439 . . . . 0.0 114.25 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -89.08 -14.24 36.78 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 112.838 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.36 166.35 18.8 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.065 1.346 . . . . 0.0 112.339 167.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -124.04 165.5 17.37 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.585 1.183 . . . . 0.0 112.33 173.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.55 60.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.592 1.157 . . . . 0.0 112.932 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -65.11 -44.96 87.05 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.454 1.501 . . . . 0.0 111.942 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.27 -32.0 73.42 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.566 -1.334 . . . . 0.0 112.76 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tp -72.51 -47.89 44.88 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.302 0.641 . . . . 0.0 111.555 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.5 p -63.46 -28.68 70.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.443 1.097 . . . . 0.0 113.077 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.71 -37.3 76.5 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.844 1.258 . . . . 0.0 113.34 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -104.4 -33.21 8.69 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -175.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 tt -84.89 -17.69 37.11 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 176.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.89 69.51 0.67 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.43 1.892 . . . . 0.0 112.373 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -134.45 168.9 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.019 2.127 . . . . 0.0 111.254 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.6 m -69.7 136.92 51.6 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.893 1.277 . . . . 0.0 110.042 166.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.2 t -58.09 -35.48 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.169 0.988 . . . . 0.0 111.832 -178.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -69.95 -26.59 64.19 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -78.75 -33.36 46.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.891 169.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -49.47 68.66 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.749 0.704 . . . . 0.0 110.716 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -67.54 -21.04 65.48 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 t -96.33 -35.13 11.32 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.939 0.791 . . . . 0.0 113.047 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -57.72 -43.32 85.2 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.874 0.87 . . . . 0.0 111.935 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.2 mt -46.39 -62.51 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.076 1.35 . . . . 0.0 110.653 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -81.03 5.34 16.76 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -110.05 -31.24 7.44 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.275 1.03 . . . . 0.0 112.766 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.0 t -83.2 -39.26 21.2 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.728 1.211 . . . . 0.0 112.045 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.29 81.98 1.88 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.593 1.557 . . . . 0.0 110.935 175.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -73.52 -31.85 63.91 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.535 1.134 . . . . 0.0 113.589 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 23.1 mmt -133.91 -34.16 1.01 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.871 1.668 . . . . 0.0 112.379 172.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 123.52 -93.85 0.48 Allowed Glycine 0 CA--C 1.527 0.835 0 C-N-CA 125.572 1.558 . . . . 0.0 110.299 -177.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -79.57 39.43 0.41 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.243 1.817 . . . . 0.0 114.106 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m 50.27 29.64 3.88 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 127.965 2.506 . . . . 0.0 114.014 177.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.277 0.7 OUTLIER 47.86 25.05 0.67 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.47 1.908 . . . . 0.0 115.324 -170.665 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.65 -3.56 49.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.615 1.166 . . . . 0.0 113.71 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -75.02 18.77 0.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.839 2.056 . . . . 0.0 114.333 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -68.97 -16.76 63.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.543 2.337 . . . . 0.0 114.003 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 t -144.11 -19.26 0.57 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.582 1.553 . . . . 0.0 113.19 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.98 156.54 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 126.029 1.732 . . . . 0.0 108.896 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.3 -0.38 0.67 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -171.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.5 ptm -125.1 -3.04 7.6 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.298 1.439 . . . . 0.0 114.5 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -129.28 -19.68 3.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -163.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -88.73 153.25 21.24 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.829 1.252 . . . . 0.0 112.371 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -146.35 148.72 32.66 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.505 1.522 . . . . 0.0 110.9 176.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -119.53 143.25 47.69 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.168 1.387 . . . . 0.0 112.208 -176.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.9 t -124.07 -46.51 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 124.629 1.172 . . . . 0.0 111.441 -177.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 57.8 p -113.35 2.22 15.41 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.532 1.533 . . . . 0.0 114.34 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.5 m -132.27 18.87 4.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.666 1.586 . . . . 0.0 114.206 -172.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.35 162.44 27.89 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.465 1.106 . . . . 0.0 113.394 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 69.8 m -131.04 162.23 30.26 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.819 1.648 . . . . 0.0 111.561 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.03 33.53 0.28 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.829 1.652 . . . . 0.0 113.671 -176.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 47.2 58.98 17.03 Favored Pre-proline 0 CA--C 1.553 1.077 0 C-N-CA 127.508 2.323 . . . . 0.0 114.01 -177.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -76.72 63.65 7.43 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 124.938 3.759 . . . . 0.0 112.48 -177.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -121.7 27.83 7.98 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.79 1.636 . . . . 0.0 112.981 -174.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 6.6 mp -118.62 82.22 19.56 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.074 1.75 . . . . 0.0 109.753 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.254 1.293 0 C-N-CA 123.853 3.035 . . . . 0.0 113.321 -179.573 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 52.4 m -134.71 160.77 37.12 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.609 1.563 . . . . 0.0 112.049 -177.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -130.37 138.88 50.61 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.127 1.371 . . . . 0.0 111.359 177.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.2 mmt -129.12 95.31 4.02 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.937 1.295 . . . . 0.0 110.945 -173.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -142.45 19.57 2.05 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.986 1.314 . . . . 0.0 114.044 -176.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.2 t -96.02 2.54 53.45 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.809 1.244 . . . . 0.0 114.339 -173.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -147.86 0.25 0.64 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 -174.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -125.57 3.79 7.58 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.58 1.552 . . . . 0.0 112.854 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.25 34.69 1.2 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.873 1.669 . . . . 0.0 111.247 -165.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -132.05 14.87 4.72 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -169.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -110.66 -56.77 2.31 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.429 1.092 . . . . 0.0 113.604 -176.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -109.66 92.92 4.24 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.716 1.206 . . . . 0.0 110.66 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.5 mm -126.82 121.69 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.784 1.634 . . . . 0.0 108.803 178.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 57.9 mt -137.13 127.73 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.373 1.469 . . . . 0.0 108.845 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -136.31 73.43 1.46 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.969 1.308 . . . . 0.0 110.712 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -152.75 -175.04 5.13 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.234 1.414 . . . . 0.0 110.982 -177.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.323 13.1 tt 50.39 39.57 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 127.534 2.333 . . . . 0.0 114.928 172.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -144.89 -166.24 2.36 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.617 1.167 . . . . 0.0 112.634 -172.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -70.08 88.42 0.59 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.393 1.077 . . . . 0.0 110.463 168.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -133.09 138.77 46.83 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.966 2.106 . . . . 0.0 110.162 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.88 -84.67 0.1 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.858 1.263 . . . . 0.0 111.316 -177.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.7 mp -127.35 -8.28 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 125.305 1.442 . . . . 0.0 113.618 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -73.39 -9.27 58.52 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -169.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.2 t -99.77 -56.33 2.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.825 1.25 . . . . 0.0 112.059 174.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -69.76 -16.43 63.31 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -172.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.6 p -75.35 -15.67 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.045 0.938 . . . . 0.0 112.93 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.5 t -120.47 71.57 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 125.675 1.59 . . . . 0.0 109.786 176.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 tp -140.84 140.68 34.68 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.561 1.144 . . . . 0.0 111.844 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.0 ttmm -121.79 34.14 5.28 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.456 1.902 . . . . 0.0 112.991 -176.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 t30 48.02 64.58 8.35 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 126.346 1.858 . . . . 0.0 113.143 -176.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.76 88.53 0.78 Allowed 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.86 3.04 . . . . 0.0 112.405 -173.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -141.66 -53.75 0.45 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.431 1.492 . . . . 0.0 113.169 176.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.4 t -135.77 77.94 50.0 Favored Pre-proline 0 N--CA 1.482 1.162 0 C-N-CA 124.274 1.03 . . . . 0.0 111.603 -173.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -82.1 96.77 0.89 Allowed 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.22 2.613 . . . . 0.0 111.895 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.1 t -151.3 29.5 0.63 Allowed 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 125.034 1.334 . . . . 0.0 113.757 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -86.06 16.05 4.56 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 -172.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.39 56.78 3.17 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 127.0 2.12 . . . . 0.0 111.776 -170.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.5 t -132.16 5.58 4.15 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 116.058 1.873 . . . . 0.0 116.058 -161.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 164.07 47.97 0.02 OUTLIER Glycine 0 N--CA 1.476 1.316 0 O-C-N 120.697 -1.252 . . . . 0.0 115.765 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -75.06 -48.31 24.57 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.46 1.13 . . . . 0.0 113.671 -171.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp -147.3 145.22 29.3 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.423 2.289 . . . . 0.0 108.983 174.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.1 t -140.6 -62.79 0.49 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.769 1.228 . . . . 0.0 114.084 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -161.11 -26.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -165.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -105.11 12.26 32.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.658 1.583 . . . . 0.0 111.351 176.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -118.7 -48.98 2.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.193 0.997 . . . . 0.0 112.354 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.24 -22.71 65.68 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.512 -1.367 . . . . 0.0 112.891 171.381 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -66.47 -11.11 50.59 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 169.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.2 mp -95.01 -60.73 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.54 1.536 . . . . 0.0 108.145 169.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.5 t -77.32 -50.77 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.32 65.09 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.563 -0.711 . . . . 0.0 111.924 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -72.97 -35.29 66.87 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.163 1.385 . . . . 0.0 113.313 168.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.35 -36.98 84.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.822 -1.174 . . . . 0.0 111.58 174.293 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.18 -21.62 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 O-C-N 121.103 -0.998 . . . . 0.0 111.596 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.0 m -89.68 -5.32 57.17 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.746 1.219 . . . . 0.0 114.121 169.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -111.62 -33.21 6.42 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.958 1.254 . . . . 0.0 113.243 -173.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -138.11 -14.16 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 114.911 1.448 . . . . 0.0 114.911 -177.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.86 -80.82 0.34 Allowed Glycine 0 N--CA 1.469 0.885 0 C-N-CA 125.135 1.35 . . . . 0.0 112.538 167.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 57.3 tp -168.88 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.153 1.781 . . . . 0.0 111.559 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -116.49 -5.07 11.72 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -165.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.4 m-80 -99.41 -18.74 17.33 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 118.603 0.638 . . . . 0.0 112.671 -178.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pp -65.94 158.01 29.21 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.169 1.388 . . . . 0.0 112.227 170.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -113.02 171.17 7.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.338 1.066 . . . . 0.0 111.661 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.29 -19.88 30.88 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.609 1.164 . . . . 0.0 112.798 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -67.59 -45.92 74.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.031 1.732 . . . . 0.0 112.257 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -65.83 -37.91 87.51 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.698 -1.251 . . . . 0.0 111.983 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.56 -52.93 62.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.69 0.796 . . . . 0.0 111.981 172.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.5 p -62.83 -22.69 66.83 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.044 0.938 . . . . 0.0 113.193 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.8 mttm -77.84 -42.53 33.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.631 1.573 . . . . 0.0 112.598 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -86.55 -38.56 17.06 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.167 0.987 . . . . 0.0 113.231 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 53.1 mt -88.51 -17.6 29.96 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.67 1.188 . . . . 0.0 113.186 -175.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.21 33.3 21.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 125.326 1.45 . . . . 0.0 113.168 -178.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.7 pt -89.86 163.94 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.772 2.029 . . . . 0.0 110.46 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.0 t -72.39 151.7 42.48 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 121.578 -0.702 . . . . 0.0 110.926 165.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.4 t -57.4 -35.15 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 124.584 1.153 . . . . 0.0 111.372 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -71.73 -32.57 67.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 178.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -69.15 -36.43 77.41 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.789 169.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.6 70.61 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.199 0.909 . . . . 0.0 110.705 176.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -54.19 -42.06 69.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.017 1.727 . . . . 0.0 113.128 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.1 t -85.17 -39.53 17.75 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -59.53 -37.71 79.08 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.804 -1.185 . . . . 0.0 112.893 178.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.0 mt -48.2 -42.07 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.57 1.148 . . . . 0.0 111.914 174.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -95.19 -39.33 10.15 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -71.5 -21.05 61.98 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.221 -0.925 . . . . 0.0 113.42 -175.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.5 t -89.48 -39.44 13.34 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.015 0.926 . . . . 0.0 113.338 173.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -143.97 54.05 1.3 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -169.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 40.4 ttt-85 -55.49 -42.12 73.97 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.005 1.722 . . . . 0.0 113.681 -178.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 76.5 mtm -107.53 -13.23 15.12 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.842 1.257 . . . . 0.0 113.83 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 108.51 122.07 4.63 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 125.508 1.528 . . . . 0.0 111.233 175.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 59.6 mtt-85 45.87 42.83 9.49 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.089 1.756 . . . . 0.0 113.329 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.58 25.57 2.06 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 128.027 2.531 . . . . 0.0 114.692 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.42 27.29 4.79 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.429 1.892 . . . . 0.0 113.757 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.03 -16.41 22.73 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.146 0.978 . . . . 0.0 113.324 -179.295 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -74.38 12.35 0.78 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.655 1.982 . . . . 0.0 115.435 -171.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 6.5 47.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.076 2.151 . . . . 0.0 114.795 -167.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 96.8 m -142.88 -46.59 0.31 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.032 1.733 . . . . 0.0 110.135 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.7 pt -73.87 170.74 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.279 1.432 . . . . 0.0 111.955 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 64.97 -3.79 0.55 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.613 1.965 . . . . 0.0 116.17 176.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 21.6 ptt? -140.23 18.84 2.42 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -144.28 -31.83 0.44 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -68.47 145.87 53.67 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.293 1.437 . . . . 0.0 113.224 175.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -149.44 164.17 35.74 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.357 1.463 . . . . 0.0 113.098 -174.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -134.09 141.33 47.12 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.627 1.571 . . . . 0.0 111.595 177.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.7 t -134.14 -50.72 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.866 1.266 . . . . 0.0 111.546 177.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.0 p -113.71 11.8 18.21 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.805 1.642 . . . . 0.0 114.106 -176.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 t 55.15 50.47 15.15 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.618 1.567 . . . . 0.0 113.356 -176.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -123.31 130.89 53.37 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.397 1.479 . . . . 0.0 111.503 178.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.2 m -142.37 116.51 9.45 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.23 1.412 . . . . 0.0 111.064 -176.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.96 29.22 7.54 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.415 1.486 . . . . 0.0 114.673 -176.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -117.15 153.58 49.79 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 126.895 2.078 . . . . 0.0 112.135 -172.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.09 80.49 2.86 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 124.178 3.252 . . . . 0.0 112.112 -175.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -129.37 83.53 2.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.637 1.575 . . . . 0.0 110.423 -178.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 22.4 tp -138.56 84.07 19.39 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.97 1.308 . . . . 0.0 110.593 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--O 1.253 1.275 0 C-N-CA 123.925 3.083 . . . . 0.0 113.288 -178.672 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 19.8 t -141.56 151.52 43.28 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.348 1.459 . . . . 0.0 111.237 177.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -105.44 99.6 9.21 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.516 1.126 . . . . 0.0 111.088 -174.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 97.4 mmm -124.77 94.58 4.23 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.384 1.474 . . . . 0.0 110.277 -177.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -153.11 -42.3 0.1 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.816 1.247 . . . . 0.0 113.298 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 56.6 p 57.01 -42.32 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 131.098 3.759 . . . . 0.0 117.352 -178.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.4 mtm -93.41 -12.03 30.82 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.316 1.446 . . . . 0.0 114.438 -173.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -97.51 4.7 50.34 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.538 1.535 . . . . 0.0 113.692 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -126.5 16.73 7.61 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.258 1.423 . . . . 0.0 114.791 -171.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.3 mp -77.78 66.65 3.5 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.194 1.398 . . . . 0.0 111.159 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -141.54 -10.67 0.93 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.991 1.317 . . . . 0.0 114.208 -176.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -130.5 124.54 32.18 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.99 1.316 . . . . 0.0 111.342 174.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 22.8 mm -129.34 84.47 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.808 1.643 . . . . 0.0 107.569 179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.3 mt -128.4 116.66 42.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 125.204 1.402 . . . . 0.0 108.556 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -138.4 115.89 11.27 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.943 1.297 . . . . 0.0 110.292 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -154.64 170.96 20.29 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.995 1.718 . . . . 0.0 111.151 178.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.35 11.4 tt 51.31 35.09 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 127.014 2.125 . . . . 0.0 115.547 173.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.71 164.13 20.58 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.035 1.734 . . . . 0.0 112.342 174.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -75.79 42.12 0.23 Allowed 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 126.54 1.936 . . . . 0.0 114.194 -175.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -137.18 130.97 31.85 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.751 1.62 . . . . 0.0 110.969 176.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.31 -75.75 0.11 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.618 1.167 . . . . 0.0 111.685 171.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.2 mt -121.64 -8.76 9.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 125.439 1.496 . . . . 0.0 113.394 -172.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -70.6 -15.84 62.79 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -172.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 28.7 t -80.64 -49.02 11.79 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.935 0.894 . . . . 0.0 112.357 175.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -81.03 -17.68 49.4 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -174.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.5 p -80.86 -18.88 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.165 0.986 . . . . 0.0 112.864 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.5 t -110.19 64.88 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 125.478 1.511 . . . . 0.0 110.146 177.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.5 mt -120.13 110.24 16.4 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.288 1.435 . . . . 0.0 110.317 175.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -134.06 43.72 2.8 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.183 1.793 . . . . 0.0 111.623 -168.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.0 t30 50.58 59.77 15.81 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 126.953 2.101 . . . . 0.0 113.692 -175.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -81.2 58.73 7.09 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 124.329 3.353 . . . . 0.0 113.884 -167.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -138.7 13.59 2.72 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.8 t -119.66 104.1 45.32 Favored Pre-proline 0 N--CA 1.473 0.698 0 C-N-CA 125.653 1.581 . . . . 0.0 110.038 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -77.83 111.46 3.11 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.27 2.647 . . . . 0.0 110.197 168.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 t -140.87 51.28 1.63 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 123.629 1.68 . . . . 0.0 111.932 -175.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -95.44 19.39 10.97 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -170.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.39 34.43 0.81 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 127.008 2.123 . . . . 0.0 112.103 -179.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.7 t -151.04 65.38 0.91 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 124.024 1.869 . . . . 0.0 111.171 -173.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.52 -13.71 38.99 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 124.91 1.243 . . . . 0.0 115.223 179.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -79.69 -56.17 4.48 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 118.719 1.259 . . . . 0.0 112.405 174.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.4 109.13 4.38 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.3 1.44 . . . . 0.0 112.07 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.9 t -99.16 -72.0 0.67 Allowed 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 125.587 1.555 . . . . 0.0 111.652 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -161.41 -46.56 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.949 0.499 . . . . 0.0 110.631 -174.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -56.11 -38.47 70.8 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.997 0.919 . . . . 0.0 110.469 172.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -67.37 -36.7 81.89 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.773 1.229 . . . . 0.0 111.8 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mtmt -69.07 -37.5 78.51 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 121.387 -0.821 . . . . 0.0 112.144 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -65.17 -2.44 2.92 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 170.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.7 mt -103.45 -60.98 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.253 1.421 . . . . 0.0 110.411 161.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.0 t -74.52 -53.58 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 CA-C-N 119.776 1.171 . . . . 0.0 113.128 -168.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.98 -34.3 78.11 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.579 -0.7 . . . . 0.0 110.853 177.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.96 -34.04 75.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 170.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.02 75.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.082 -1.011 . . . . 0.0 111.954 174.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.52 -32.17 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.171 -0.956 . . . . 0.0 110.697 172.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.5 m -74.96 -11.64 60.16 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -105.08 -39.45 6.22 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.291 1.405 . . . . 0.0 112.899 -172.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.6 p -129.35 -15.88 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -170.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.81 -85.43 0.23 Allowed Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.726 1.155 . . . . 0.0 111.919 171.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.3 tt -165.88 -41.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.727 1.611 . . . . 0.0 111.142 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -110.32 -6.68 14.94 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.883 1.673 . . . . 0.0 115.305 -169.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -95.89 -14.17 23.36 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 -173.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.88 159.69 24.95 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.349 1.459 . . . . 0.0 114.688 -178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.7 t-20 -101.0 122.86 44.28 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.961 1.304 . . . . 0.0 111.474 -177.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.98 -21.13 64.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.866 1.266 . . . . 0.0 113.479 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 93.5 m -66.24 -41.33 90.18 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.399 -0.813 . . . . 0.0 111.491 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.91 -43.07 99.61 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.05 -1.031 . . . . 0.0 111.721 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -57.92 -44.56 86.91 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 112.286 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 p -61.86 -27.14 68.57 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.254 -0.904 . . . . 0.0 113.3 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -84.16 -38.5 20.58 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.807 1.643 . . . . 0.0 111.91 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.2 mmt-85 -91.17 -34.67 14.93 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.041 1.336 . . . . 0.0 114.276 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -92.96 -12.69 30.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.364 1.065 . . . . 0.0 112.937 174.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.73 65.33 1.25 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.056 1.343 . . . . 0.0 112.045 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -133.19 163.06 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.601 1.96 . . . . 0.0 111.586 -177.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.5 m -57.43 134.31 55.95 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.912 1.285 . . . . 0.0 109.65 163.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.8 t -59.1 -34.58 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 121.569 -0.707 . . . . 0.0 111.389 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.06 -29.01 64.78 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.249 -0.907 . . . . 0.0 113.363 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.71 -36.36 78.34 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.896 169.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.83 -50.13 65.72 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.08 0.855 . . . . 0.0 110.811 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -54.78 -38.83 67.73 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.195 1.398 . . . . 0.0 112.815 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.4 t -88.15 -34.98 17.67 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 177.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.64 -38.01 83.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.085 -1.009 . . . . 0.0 112.266 177.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.8 mt -48.01 -60.07 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.813 1.245 . . . . 0.0 110.954 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -75.04 -21.9 58.76 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -82.06 -31.68 30.73 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.023 0.829 . . . . 0.0 112.83 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.4 t -85.36 -43.58 13.55 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.765 1.226 . . . . 0.0 112.595 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -133.88 84.24 2.11 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.065 1.346 . . . . 0.0 111.319 178.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -76.89 -41.12 45.0 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.605 0.762 . . . . 0.0 112.936 174.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 66.1 mtt -122.0 -29.59 4.23 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.757 1.623 . . . . 0.0 112.695 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.29 107.63 2.81 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.626 1.584 . . . . 0.0 111.513 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? 44.52 39.2 3.08 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.109 1.764 . . . . 0.0 112.827 -177.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 47.11 30.75 1.42 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.298 2.239 . . . . 0.0 114.021 -178.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 53.91 21.51 2.85 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 125.698 1.599 . . . . 0.0 114.926 -172.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . 0.262 0.0 OUTLIER -101.9 27.6 6.39 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 120.042 -1.661 . . . . 0.0 113.07 -172.167 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -114.63 9.95 16.64 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.51 1.524 . . . . 0.0 113.809 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.0 pttt -93.91 -20.85 19.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.399 1.879 . . . . 0.0 115.041 -158.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 m -154.57 -51.48 0.09 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.335 1.854 . . . . 0.0 110.494 -169.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.7 pt -72.02 -174.66 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 111.382 171.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 65.03 -27.2 0.1 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.499 2.32 . . . . 0.0 116.386 -172.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -87.74 -18.57 29.15 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.943 1.247 . . . . 0.0 114.021 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -116.68 3.62 13.06 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.788 1.235 . . . . 0.0 114.135 178.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -100.86 147.07 26.52 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 112.782 -173.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -138.16 42.78 2.22 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.587 1.555 . . . . 0.0 112.079 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -138.54 149.8 45.7 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.004 1.322 . . . . 0.0 112.913 176.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 55.6 t -136.08 -48.1 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 125.408 1.483 . . . . 0.0 111.168 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 63.2 p -118.41 24.39 10.96 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 126.504 1.922 . . . . 0.0 113.229 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . 0.283 86.7 p 52.58 21.84 1.97 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.788 2.435 . . . . 0.0 116.386 -176.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -130.98 111.82 12.39 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.673 1.589 . . . . 0.0 110.782 175.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 66.8 m -146.16 127.04 14.46 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.579 1.552 . . . . 0.0 109.679 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.0 29.99 11.04 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 -175.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -116.91 75.14 7.22 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 126.012 1.725 . . . . 0.0 112.377 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -67.01 114.63 3.25 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.171 2.581 . . . . 0.0 110.379 174.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -137.19 22.24 3.0 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -172.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.4 tp -135.42 84.9 33.48 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.47 1.508 . . . . 0.0 110.923 -174.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 C--O 1.254 1.317 0 C-N-CA 123.926 3.084 . . . . 0.0 113.237 179.685 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 111.219 -0.753 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 31.1 m 58.49 178.56 0.07 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.967 1.707 . . . . 0.0 114.12 -172.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -140.64 133.91 29.67 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.025 0.93 . . . . 0.0 111.829 -178.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 98.3 mmm -133.74 43.65 2.84 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.444 1.497 . . . . 0.0 112.324 -169.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -145.34 95.99 2.76 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.944 1.298 . . . . 0.0 111.276 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.3 m -118.06 7.89 12.33 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.468 1.507 . . . . 0.0 114.493 -175.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -151.69 -9.12 0.21 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -178.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -105.18 2.53 29.29 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.712 1.605 . . . . 0.0 112.369 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.48 15.94 2.01 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.046 1.739 . . . . 0.0 112.217 -166.444 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.9 mp -107.64 132.05 53.73 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.752 1.221 . . . . 0.0 110.361 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -149.22 -35.66 0.18 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.906 1.282 . . . . 0.0 112.645 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -83.39 42.91 0.85 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.819 1.647 . . . . 0.0 113.068 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.5 mm -105.75 134.51 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.589 1.555 . . . . 0.0 110.816 -173.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 73.9 mt -89.65 135.19 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.075 1.35 . . . . 0.0 109.726 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -134.61 164.23 27.96 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.276 1.43 . . . . 0.0 112.499 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -138.68 166.24 24.88 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.789 1.636 . . . . 0.0 111.339 -175.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.328 14.9 tt 47.94 43.23 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 C-N-CA 126.931 2.092 . . . . 0.0 114.042 173.397 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.98 63.19 3.73 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.377 1.471 . . . . 0.0 113.096 -168.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt 52.41 44.86 29.47 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.714 1.606 . . . . 0.0 112.562 -176.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.05 111.39 9.16 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.843 1.257 . . . . 0.0 111.488 -174.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.38 -81.73 0.64 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.651 1.181 . . . . 0.0 112.708 175.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.4 mt -115.15 -11.47 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -167.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -71.63 -18.91 62.18 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -173.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -81.76 -42.77 19.29 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.395 1.078 . . . . 0.0 112.795 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -83.92 -17.91 39.14 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -175.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.3 t -81.2 -32.85 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.521 1.128 . . . . 0.0 111.667 177.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.7 t -113.02 77.41 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.025 1.33 . . . . 0.0 109.851 -176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.6 tt -126.72 131.31 51.38 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.638 1.575 . . . . 0.0 110.399 -177.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -130.09 45.44 2.81 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.406 1.883 . . . . 0.0 112.483 -171.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -126.63 56.04 16.03 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 124.84 1.256 . . . . 0.0 113.604 177.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.2 91.01 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.962 2.441 . . . . 0.0 110.796 175.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.4 mmt-85 -134.29 -69.43 0.53 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.619 1.568 . . . . 0.0 112.412 178.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 93.9 t -149.24 115.53 3.66 Favored Pre-proline 0 N--CA 1.475 0.781 0 C-N-CA 125.094 1.357 . . . . 0.0 109.711 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.35 157.26 25.78 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.976 2.45 . . . . 0.0 112.251 165.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.7 p -85.35 18.38 2.7 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 126.638 1.975 . . . . 0.0 115.462 178.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -113.71 81.82 1.58 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.254 1.022 . . . . 0.0 111.734 -169.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -129.53 35.2 4.24 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.931 1.692 . . . . 0.0 113.134 -178.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.9 t -138.46 10.8 2.74 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.964 1.305 . . . . 0.0 114.194 -166.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.41 -64.58 2.58 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 120.733 -1.23 . . . . 0.0 113.922 -173.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -127.2 1.77 6.43 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.857 1.263 . . . . 0.0 113.866 -171.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp -133.69 134.37 43.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.58 1.552 . . . . 0.0 111.207 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.3 p -106.52 -83.05 0.53 Allowed 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.76 2.424 . . . . 0.0 111.688 -178.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -155.48 -48.97 0.08 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 124.664 1.186 . . . . 0.0 110.774 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.36 -28.55 69.36 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.497 0.719 . . . . 0.0 110.958 172.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -68.69 -37.1 79.3 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.231 1.012 . . . . 0.0 111.775 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -69.24 -34.06 74.24 Favored 'General case' 0 N--CA 1.481 1.112 0 O-C-N 120.788 -1.195 . . . . 0.0 112.971 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -63.56 -3.67 2.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 169.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.6 mt -109.01 -49.67 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.674 1.59 . . . . 0.0 110.687 168.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.96 -65.1 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.71 1.141 . . . . 0.0 112.321 -177.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.28 73.71 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.668 0.787 . . . . 0.0 111.439 -173.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.7 -43.17 94.18 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 170.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -72.0 -35.78 69.56 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.229 -0.92 . . . . 0.0 112.086 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.63 -29.16 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.916 1.286 . . . . 0.0 111.536 170.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.0 t -77.06 -17.46 58.75 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 173.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -95.55 -50.14 5.09 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.704 -1.247 . . . . 0.0 111.996 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.03 -7.1 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -168.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 116.19 -76.08 0.27 Allowed Glycine 0 N--CA 1.467 0.765 0 C-N-CA 125.476 1.512 . . . . 0.0 112.83 163.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -175.05 -33.85 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 127.031 2.133 . . . . 0.0 111.186 179.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -111.72 -6.1 14.37 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.175 1.39 . . . . 0.0 114.536 -165.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -97.32 -21.33 17.29 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.159 0.984 . . . . 0.0 113.236 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.2 pp -68.09 167.05 14.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.53 0.732 . . . . 0.0 112.383 167.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -128.07 170.11 13.3 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.501 1.144 . . . . 0.0 112.28 174.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.94 -32.54 61.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.061 1.344 . . . . 0.0 112.947 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.42 -52.29 64.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.006 1.322 . . . . 0.0 111.149 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.29 -34.28 77.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.066 0.946 . . . . 0.0 112.341 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 tp -66.92 -47.98 70.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.008 0.523 . . . . 0.0 111.361 173.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -60.18 -25.36 65.51 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.853 1.261 . . . . 0.0 113.98 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -82.13 -16.73 48.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.006 1.723 . . . . 0.0 113.434 -177.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -119.85 -42.46 2.61 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.77 1.628 . . . . 0.0 112.137 -175.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tp -76.39 -12.42 60.05 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.371 1.868 . . . . 0.0 112.454 172.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.31 64.56 1.34 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.344 1.858 . . . . 0.0 112.592 170.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.8 pt -139.11 174.74 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 127.588 2.355 . . . . 0.0 109.966 -176.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.8 t -75.8 151.59 37.49 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.532 -0.73 . . . . 0.0 110.769 163.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.9 t -60.57 -34.28 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.025 0.93 . . . . 0.0 111.293 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.19 -31.92 72.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -69.23 -35.69 76.42 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.19 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.31 -45.13 73.81 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.02 0.827 . . . . 0.0 110.946 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.78 -39.12 73.5 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.079 1.351 . . . . 0.0 112.813 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -87.3 -40.38 14.54 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.21 -41.65 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.063 -1.023 . . . . 0.0 112.241 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.3 mt -54.68 -36.94 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 124.311 1.044 . . . . 0.0 112.695 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -92.93 -34.6 13.72 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.948 1.249 . . . . 0.0 113.001 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -73.22 -31.94 64.45 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 123.162 0.585 . . . . 0.0 112.536 -170.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 72.6 m -89.2 -33.41 17.03 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.195 1.398 . . . . 0.0 113.701 178.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -152.52 83.48 1.24 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.007 1.323 . . . . 0.0 111.16 -178.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -75.94 -18.66 59.26 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.971 1.308 . . . . 0.0 113.718 176.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 75.5 mtm -82.62 46.93 1.12 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.024 1.73 . . . . 0.0 114.748 -156.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -178.01 17.62 0.03 OUTLIER Glycine 0 CA--C 1.539 1.565 0 C-N-CA 125.544 1.545 . . . . 0.0 114.803 177.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 73.1 mtp85 -87.53 -53.95 4.53 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.033 1.333 . . . . 0.0 113.378 -174.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.8 t -141.8 9.37 1.96 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 126.522 1.929 . . . . 0.0 112.865 -177.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 m120 53.46 20.1 1.91 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.08 2.152 . . . . 0.0 115.894 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -87.72 -4.85 58.89 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.086 1.354 . . . . 0.0 113.85 -175.286 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -75.93 8.79 2.83 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.484 1.914 . . . . 0.0 115.004 -166.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -85.73 -7.11 58.98 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.918 1.687 . . . . 0.0 114.704 -170.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.5 m -139.39 -43.89 0.45 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.216 1.807 . . . . 0.0 110.315 -165.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 40.1 pt -64.94 172.23 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.832 0.853 . . . . 0.0 111.92 170.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? 66.07 -18.28 0.11 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 127.387 2.275 . . . . 0.0 116.734 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.47 -15.55 8.02 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.402 1.456 . . . . 0.0 114.531 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -104.28 -25.36 12.91 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -165.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -80.41 129.67 34.66 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.7 0.8 . . . . 0.0 112.477 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -159.92 131.57 6.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.158 1.383 . . . . 0.0 111.615 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -148.02 142.08 25.97 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.12 1.768 . . . . 0.0 110.288 172.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.5 t -134.55 -50.65 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 124.15 0.98 . . . . 0.0 111.989 178.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.2 m -111.9 3.74 17.77 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.399 1.079 . . . . 0.0 113.829 -173.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.3 m -116.28 -3.6 11.95 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -164.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.43 131.97 34.15 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.212 1.005 . . . . 0.0 112.556 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.2 t -153.79 170.0 22.0 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.943 1.697 . . . . 0.0 109.902 171.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.63 -31.77 72.68 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -156.22 154.03 26.52 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 126.986 2.114 . . . . 0.0 112.838 173.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -81.94 69.53 7.54 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.325 3.35 . . . . 0.0 112.213 -175.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -126.91 87.44 2.65 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.237 1.415 . . . . 0.0 111.16 -175.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 74.3 mt -66.75 -52.51 33.17 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.61 1.164 . . . . 0.0 114.117 169.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 C--O 1.252 1.221 0 C-N-CA 124.113 3.209 . . . . 0.0 112.896 174.353 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 112.109 -0.396 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 21.0 m 52.76 41.38 31.58 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 125.738 1.615 . . . . 0.0 114.746 174.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -74.16 112.83 10.69 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.85 0.86 . . . . 0.0 112.199 -172.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 86.5 mtp -134.42 89.59 2.57 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.987 1.715 . . . . 0.0 109.38 174.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -158.49 117.26 3.05 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.391 1.876 . . . . 0.0 108.074 175.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 34.2 t -137.52 -49.2 0.59 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.129 1.372 . . . . 0.0 112.451 169.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.2 mtt -74.91 -13.63 60.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -170.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -113.96 12.36 18.03 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 127.011 2.125 . . . . 0.0 111.643 174.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.42 42.04 0.9 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.749 1.62 . . . . 0.0 111.71 -162.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tp -135.6 2.99 2.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -87.04 -32.63 19.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -164.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -131.64 15.17 4.91 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.35 1.46 . . . . 0.0 113.731 -175.03 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 25.9 mm -73.21 131.47 34.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 125.053 1.341 . . . . 0.0 111.684 -171.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.3 tp -150.27 126.87 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 110.744 171.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -162.4 159.25 25.01 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.618 1.567 . . . . 0.0 112.045 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.1 pm0 -90.58 178.31 6.12 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.645 1.178 . . . . 0.0 113.058 168.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.5 tp -113.13 13.89 8.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.973 0 C-N-CA 126.971 2.108 . . . . 0.0 113.64 -173.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -140.54 160.1 40.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.774 1.63 . . . . 0.0 112.257 -170.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -82.2 8.56 10.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.029 1.332 . . . . 0.0 113.946 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -100.84 141.03 34.3 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.948 1.699 . . . . 0.0 110.755 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -147.32 -82.07 0.13 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.66 1.584 . . . . 0.0 112.16 174.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 95.2 mt -123.96 4.26 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.968 1.707 . . . . 0.0 111.96 -171.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -91.59 0.52 57.49 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.642 -1.286 . . . . 0.0 113.87 -173.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.0 p -122.76 -49.89 1.98 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.273 1.429 . . . . 0.0 112.931 -174.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -65.53 -27.35 68.39 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.369 1.468 . . . . 0.0 114.542 177.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.5 t -89.07 -26.04 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 125.141 1.376 . . . . 0.0 111.895 175.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.6 t -125.95 75.2 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.447 1.499 . . . . 0.0 110.229 -173.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -124.92 143.2 50.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.639 1.576 . . . . 0.0 111.651 -177.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -113.21 16.44 19.12 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 125.714 1.606 . . . . 0.0 114.312 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -135.11 60.17 38.22 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 124.786 1.235 . . . . 0.0 112.988 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -81.92 56.35 5.83 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.556 2.837 . . . . 0.0 112.48 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -133.81 -82.38 0.46 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.428 1.491 . . . . 0.0 112.558 -169.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.9 t -141.07 100.12 6.49 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 124.778 1.231 . . . . 0.0 110.452 -174.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -79.9 157.98 24.17 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.93 2.42 . . . . 0.0 113.248 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.6 p -79.27 59.8 2.92 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.255 2.622 . . . . 0.0 113.682 -173.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -86.77 16.19 5.04 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -170.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.03 63.07 7.14 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 126.257 1.823 . . . . 0.0 111.822 -163.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.8 t -142.23 10.89 1.93 Allowed 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 114.56 1.319 . . . . 0.0 114.56 -171.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.26 -45.37 70.65 Favored Glycine 0 CA--C 1.538 1.474 0 O-C-N 120.705 -1.247 . . . . 0.0 115.204 -171.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -131.91 -55.36 0.99 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.965 1.306 . . . . 0.0 112.159 -178.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.3 mp -110.66 114.16 27.32 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 127.258 2.223 . . . . 0.0 108.398 177.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.6 p -98.01 -71.16 0.7 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.375 1.07 . . . . 0.0 111.869 172.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -159.69 -29.05 0.06 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -170.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -85.86 -28.92 24.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.165 0.586 . . . . 0.0 110.684 173.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -78.03 -39.32 42.38 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.242 -0.911 . . . . 0.0 111.257 -167.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -68.34 -29.92 68.76 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.746 0.818 . . . . 0.0 112.566 171.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.11 -7.62 13.11 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -103.29 -56.47 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.956 1.302 . . . . 0.0 109.763 167.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -66.6 -55.84 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.753 1.16 . . . . 0.0 112.198 -173.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.92 78.93 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.739 -0.601 . . . . 0.0 111.253 -176.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -60.03 -42.72 95.0 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 170.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.21 -36.13 76.94 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.309 1.044 . . . . 0.0 112.047 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -58.81 -35.62 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 O-C-N 120.859 -1.151 . . . . 0.0 111.399 174.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.6 m -70.45 -12.3 61.49 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 173.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -91.69 -43.73 9.42 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.14 1.337 . . . . 0.0 112.178 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.1 -10.71 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -165.56 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 125.02 -79.36 0.36 Allowed Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.714 1.149 . . . . 0.0 111.696 170.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -171.23 -43.84 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.559 1.944 . . . . 0.0 111.438 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -106.73 -12.04 15.64 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.996 1.719 . . . . 0.0 114.667 -167.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -90.12 -21.7 22.13 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -175.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.07 164.59 8.2 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.664 1.186 . . . . 0.0 113.224 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.97 164.9 12.87 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.383 1.087 . . . . 0.0 112.139 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.88 -29.38 44.39 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.707 1.203 . . . . 0.0 113.269 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -59.81 -43.58 94.42 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 0.0 111.767 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.92 -25.81 65.66 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.637 -1.29 . . . . 0.0 113.545 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.75 -50.32 17.79 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.978 0.808 . . . . 0.0 111.445 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.3 p -59.94 -26.06 65.67 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -76.24 -26.79 56.37 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 114.074 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 78.8 mtt85 -113.87 -39.35 4.0 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.078 1.351 . . . . 0.0 113.112 -172.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 tt -84.08 -19.35 34.45 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.404 1.881 . . . . 0.0 111.112 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 60.32 72.71 0.51 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.706 2.002 . . . . 0.0 112.473 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.8 pt -135.28 164.4 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 127.367 2.267 . . . . 0.0 110.356 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.5 m -62.9 140.35 58.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.739 1.216 . . . . 0.0 109.913 166.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.9 t -57.54 -38.65 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 O-C-N 121.483 -0.76 . . . . 0.0 111.436 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.06 -26.79 60.59 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.447 -0.783 . . . . 0.0 113.102 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.39 -37.54 80.47 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 118.104 -0.95 . . . . 0.0 110.597 167.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.0 -47.51 74.24 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.286 0.948 . . . . 0.0 111.54 176.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.74 -43.77 85.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.931 1.292 . . . . 0.0 112.498 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -84.62 -34.34 23.13 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -55.37 -48.36 74.4 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.376 1.07 . . . . 0.0 111.266 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.7 mt -46.13 -59.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.752 1.221 . . . . 0.0 110.472 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -87.5 -3.22 59.0 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -172.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -98.79 -34.58 10.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.256 0.935 . . . . 0.0 112.66 170.596 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.8 m -92.45 -27.94 17.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.678 1.191 . . . . 0.0 113.348 -178.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -148.03 70.49 1.15 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.116 1.366 . . . . 0.0 111.668 178.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.0 ttp85 -66.71 -39.73 88.17 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -173.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 61.1 mtt -131.17 -22.5 2.53 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.521 1.128 . . . . 0.0 113.778 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.86 -117.74 0.49 Allowed Glycine 0 N--CA 1.47 0.934 0 CA-C-N 118.758 0.708 . . . . 0.0 111.719 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -70.92 -93.37 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.37 0.668 . . . . 0.0 109.477 161.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.31 47.99 1.12 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 178.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.4 m120 55.44 24.0 6.33 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 116.644 2.09 . . . . 0.0 116.644 168.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -108.77 -0.51 19.92 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.384 1.474 . . . . 0.0 114.038 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -76.28 19.68 0.24 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.847 1.659 . . . . 0.0 114.671 -175.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt -93.51 -2.11 54.78 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 127.103 2.161 . . . . 0.0 114.262 -162.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.1 m -148.33 -46.04 0.15 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.936 2.494 . . . . 0.0 108.763 -170.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.3 pt -73.07 161.2 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 111.424 169.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.6 mptt 61.38 18.79 9.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.526 1.53 . . . . 0.0 114.812 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 38.8 mtt -124.67 -44.96 1.94 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.833 1.253 . . . . 0.0 113.172 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -115.77 27.33 9.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.664 1.586 . . . . 0.0 112.074 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -137.37 160.94 37.66 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.199 1.8 . . . . 0.0 112.075 -167.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -88.97 152.57 21.63 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.653 1.181 . . . . 0.0 112.631 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -146.53 149.92 34.55 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.222 1.409 . . . . 0.0 112.368 178.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.9 t -139.99 -51.99 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.276 1.43 . . . . 0.0 111.131 177.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.2 m -121.4 20.04 11.26 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.258 1.423 . . . . 0.0 112.958 -176.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t -139.16 33.73 2.12 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.644 1.578 . . . . 0.0 112.966 -173.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -147.84 163.83 35.55 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.532 1.533 . . . . 0.0 112.204 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 66.6 m -143.41 140.12 30.28 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.776 1.63 . . . . 0.0 110.429 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 51.26 34.92 12.39 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.779 1.232 . . . . 0.0 113.807 -173.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -120.04 95.63 49.16 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 126.413 1.885 . . . . 0.0 111.218 -175.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -81.01 55.21 5.59 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 124.538 3.492 . . . . 0.0 111.89 -179.312 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -82.91 60.59 5.49 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.567 1.547 . . . . 0.0 112.113 -171.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -118.61 93.2 45.49 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 126.193 1.797 . . . . 0.0 110.492 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 C--O 1.254 1.276 0 C-N-CA 123.821 3.014 . . . . 0.0 113.349 -179.897 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 28.3 p -146.84 157.86 43.77 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.475 1.51 . . . . 0.0 112.37 178.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 67.8 t60 -148.18 144.09 27.49 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.858 1.263 . . . . 0.0 111.03 170.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 66.2 mtt -128.92 97.14 4.55 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.104 1.362 . . . . 0.0 110.72 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.78 101.8 2.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.925 1.69 . . . . 0.0 109.716 175.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.7 t -111.49 0.82 16.64 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.244 1.418 . . . . 0.0 114.003 -175.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.9 mtt -136.58 -5.0 2.01 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -170.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -128.19 10.72 6.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.893 1.677 . . . . 0.0 112.016 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.16 27.27 0.69 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.232 1.413 . . . . 0.0 112.304 -162.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.2 17.08 3.44 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -167.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -135.97 -18.15 1.6 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -167.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -88.96 29.43 1.04 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.228 1.811 . . . . 0.0 114.278 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.8 mp -76.92 97.51 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.475 1.11 . . . . 0.0 110.321 -178.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.5 mt -139.08 139.79 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 126.022 1.729 . . . . 0.0 109.641 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -105.73 112.08 25.01 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.976 1.31 . . . . 0.0 110.16 171.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -158.04 170.2 22.83 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.277 1.431 . . . . 0.0 111.277 -179.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 43.4 pt -118.93 116.95 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 125.967 1.707 . . . . 0.0 110.668 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -143.49 173.48 11.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.529 2.332 . . . . 0.0 110.698 -167.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -74.9 67.5 1.67 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.218 1.007 . . . . 0.0 111.18 166.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -67.41 107.05 2.3 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.892 1.277 . . . . 0.0 110.753 175.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.07 -78.02 0.58 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.649 1.18 . . . . 0.0 112.213 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.9 mt -116.17 -8.54 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -170.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -78.49 -14.82 59.18 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 -177.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.0 t -92.41 -39.65 11.31 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.134 0.974 . . . . 0.0 113.224 -168.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -71.28 -14.81 62.34 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.7 t -74.17 -27.37 21.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.458 1.503 . . . . 0.0 111.805 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.2 t -129.04 80.45 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 125.371 1.468 . . . . 0.0 109.143 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.6 tp -130.97 143.34 50.65 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.272 1.429 . . . . 0.0 111.502 -175.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -115.79 27.07 9.54 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.171 1.788 . . . . 0.0 113.332 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -129.39 56.02 21.72 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 125.299 1.44 . . . . 0.0 113.149 179.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -78.34 56.55 5.87 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 124.137 3.225 . . . . 0.0 113.884 -172.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -79.71 -54.07 6.21 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.031 1.333 . . . . 0.0 112.183 174.596 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t 45.75 106.97 0.01 OUTLIER Pre-proline 0 N--CA 1.477 0.912 0 C-N-CA 129.098 2.959 . . . . 0.0 114.378 -171.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -71.5 165.74 31.54 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.604 2.203 . . . . 0.0 113.263 -178.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.7 p -78.05 43.53 0.44 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.483 2.313 . . . . 0.0 114.94 -168.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -134.21 21.42 3.74 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.462 1.653 . . . . 0.0 115.462 -175.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.413 ' HE2' ' HA ' ' A' ' 31' ' ' LYS . 5.8 mmpt? -75.78 66.95 2.14 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.184 1.794 . . . . 0.0 111.922 173.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 t -115.64 8.39 15.01 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.036 1.734 . . . . 0.0 113.434 179.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 84.6 -0.18 89.24 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 125.328 1.442 . . . . 0.0 116.331 173.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -92.71 -48.11 6.75 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 119.623 1.712 . . . . 0.0 113.671 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 mp -146.94 121.99 10.09 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.16 1.384 . . . . 0.0 111.752 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.4 m -102.71 -72.36 0.69 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.493 1.517 . . . . 0.0 112.227 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -162.47 -44.39 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.176 0.59 . . . . 0.0 111.498 -173.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -61.26 -33.78 74.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.588 0.755 . . . . 0.0 110.916 170.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -68.77 -37.58 79.45 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.626 1.171 . . . . 0.0 111.645 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt -66.32 -35.21 79.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.146 -0.972 . . . . 0.0 112.831 171.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -65.06 -1.33 2.04 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 171.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.6 mt -113.58 -14.39 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 126.354 1.862 . . . . 0.0 112.098 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -124.73 -58.96 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.124 0.97 . . . . 0.0 112.642 -174.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.15 -37.75 86.38 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.423 1.011 . . . . 0.0 111.089 175.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.21 -32.03 73.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.713 0.805 . . . . 0.0 113.049 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -77.51 -38.4 48.97 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.027 0.931 . . . . 0.0 111.871 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.14 -33.05 52.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.7 1.2 . . . . 0.0 110.462 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -71.14 -16.38 62.55 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 171.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -104.79 -42.91 5.24 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.681 -1.262 . . . . 0.0 113.024 -171.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.2 m -127.61 -13.21 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -172.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -82.52 0.31 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 125.056 1.313 . . . . 0.0 112.195 168.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 tt -171.75 -43.86 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 111.342 -178.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -112.26 -4.08 14.44 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.003 1.721 . . . . 0.0 114.932 -168.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -93.37 -22.3 19.02 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 112.792 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 pp -66.77 165.72 14.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.946 1.298 . . . . 0.0 112.313 164.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -118.24 172.53 7.38 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.394 1.093 . . . . 0.0 111.599 171.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.0 58.0 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.686 1.194 . . . . 0.0 112.815 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -65.42 -48.06 74.11 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.729 1.611 . . . . 0.0 112.194 -173.739 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -66.47 -29.57 69.72 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.734 -1.229 . . . . 0.0 112.686 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.29 -46.97 25.43 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.326 1.45 . . . . 0.0 110.293 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.6 p -67.89 -29.3 68.37 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.02 1.328 . . . . 0.0 113.469 177.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -66.81 -39.4 87.72 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.866 1.266 . . . . 0.0 112.675 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 83.4 mtt85 -86.99 -42.08 13.4 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.384 1.074 . . . . 0.0 113.28 -179.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 tt -81.26 -18.35 46.27 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.129 1.372 . . . . 0.0 111.829 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 62.67 68.3 0.66 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.604 1.961 . . . . 0.0 112.08 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.1 pt -135.41 177.63 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 127.231 2.213 . . . . 0.0 110.833 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.7 m -73.15 144.4 46.92 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.703 1.601 . . . . 0.0 109.813 166.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.7 t -58.79 -39.89 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 O-C-N 121.442 -0.786 . . . . 0.0 111.434 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -69.63 -30.29 67.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.0 mmtt -64.5 -38.42 90.97 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.161 170.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.61 -48.26 64.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.909 0.777 . . . . 0.0 110.216 175.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -56.34 -42.63 78.04 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.837 1.255 . . . . 0.0 112.891 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 t -82.21 -38.11 25.04 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -61.59 -36.8 81.72 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.861 -1.149 . . . . 0.0 112.937 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.3 mt -49.84 -45.77 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.154 0.981 . . . . 0.0 111.191 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -93.31 -13.0 28.71 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.259 1.578 . . . . 0.0 115.259 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -82.92 -32.02 27.45 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.843 1.201 . . . . 0.0 112.409 169.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -84.42 -47.34 10.77 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.396 1.078 . . . . 0.0 112.821 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -102.82 -29.01 11.72 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -173.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.09 37.8 22.46 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 127.046 2.138 . . . . 0.0 114.471 175.084 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 15.9 mmt 62.74 -45.75 0.19 Allowed 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 128.021 2.528 . . . . 0.0 115.448 -173.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 112.65 -58.0 0.42 Allowed Glycine 0 N--CA 1.467 0.718 0 C-N-CA 127.099 2.285 . . . . 0.0 111.13 168.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -136.93 68.26 1.43 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.594 1.558 . . . . 0.0 111.316 173.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 57.3 p 55.71 32.15 18.82 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.135 1.774 . . . . 0.0 114.334 165.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -75.95 -5.28 45.47 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.62 1.568 . . . . 0.0 112.228 -171.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.94 -20.15 66.11 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 128.712 2.805 . . . . 0.0 113.592 173.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -66.66 12.56 0.07 Allowed 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.949 2.203 . . . . 0.0 116.949 -172.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -5.58 59.32 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 -169.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.7 m -139.0 -47.44 0.48 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.445 1.498 . . . . 0.0 110.806 -167.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 pt -71.12 165.1 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 124.192 0.997 . . . . 0.0 111.828 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? 65.24 -14.45 0.11 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 126.787 2.035 . . . . 0.0 116.417 176.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 49.4 mtm -85.21 -43.55 13.69 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.787 1.176 . . . . 0.0 112.783 -176.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -103.75 -7.6 20.48 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -176.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.1 100.21 10.37 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.59 1.156 . . . . 0.0 110.757 -173.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -152.93 163.97 38.8 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.32 1.448 . . . . 0.0 111.618 -175.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -72.12 143.81 48.86 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.466 1.107 . . . . 0.0 112.495 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -128.89 -51.15 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.689 1.195 . . . . 0.0 111.253 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 58.5 p -103.87 -4.31 23.67 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.067 1.347 . . . . 0.0 114.128 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.5 m -100.86 -3.15 30.34 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -171.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.9 148.82 31.12 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.344 1.058 . . . . 0.0 112.891 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.2 m -151.2 135.71 17.02 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.84 1.656 . . . . 0.0 109.775 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 51.26 35.21 13.06 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.48 1.112 . . . . 0.0 113.924 -174.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -124.44 148.67 59.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.266 1.827 . . . . 0.0 111.903 177.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -68.83 115.71 4.09 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.353 2.702 . . . . 0.0 110.988 178.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -143.55 51.99 1.34 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.763 1.225 . . . . 0.0 111.789 -173.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 95.9 mt -120.48 76.27 25.97 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.651 1.58 . . . . 0.0 111.037 -178.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 C--O 1.253 1.232 0 C-N-CA 124.043 3.162 . . . . 0.0 113.231 178.658 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 53.5 m -129.52 153.24 48.21 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.542 1.537 . . . . 0.0 111.872 -177.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -123.61 49.01 1.77 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.019 1.327 . . . . 0.0 111.987 -173.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 98.4 mmm -88.41 84.57 6.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.379 1.072 . . . . 0.0 110.775 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.0 14.76 5.23 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -173.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 59.9 m -91.21 1.24 57.25 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -169.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 ptp -150.63 -4.61 0.32 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -114.87 -8.07 12.58 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.535 1.534 . . . . 0.0 112.87 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.77 21.83 2.31 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.039 1.736 . . . . 0.0 111.662 -165.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -112.18 110.95 21.51 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.253 1.421 . . . . 0.0 109.662 173.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -147.64 23.9 1.11 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.208 1.403 . . . . 0.0 112.747 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 51.03 61.83 3.03 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.574 1.949 . . . . 0.0 114.338 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.4 mp -93.71 56.54 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 125.114 1.366 . . . . 0.0 110.839 -170.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.5 mt -117.98 108.53 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 125.118 1.367 . . . . 0.0 109.333 -176.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -152.84 -57.02 0.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.427 1.091 . . . . 0.0 111.945 177.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -153.01 147.66 26.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.335 1.454 . . . . 0.0 111.322 178.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 33.6 pt -138.82 140.06 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 127.146 2.178 . . . . 0.0 109.164 172.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.66 -72.86 0.24 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.847 1.259 . . . . 0.0 112.158 177.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -145.83 -34.88 0.3 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.667 1.987 . . . . 0.0 112.625 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -128.14 124.91 38.06 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.266 1.426 . . . . 0.0 111.56 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -146.33 -65.03 0.3 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.898 0.879 . . . . 0.0 112.37 168.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.5 tt -91.19 -21.11 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -168.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 -69.8 -15.14 63.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.88 -171.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 t -64.47 -29.81 70.85 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.573 1.149 . . . . 0.0 112.393 173.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -83.32 -30.75 27.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.978 0.911 . . . . 0.0 112.443 174.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.0 t -76.35 -44.97 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 124.831 1.252 . . . . 0.0 111.063 -173.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.4 t -99.72 71.51 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.053 1.341 . . . . 0.0 109.18 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.0 tp -142.65 155.25 44.9 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.849 1.26 . . . . 0.0 112.302 -172.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -100.41 25.29 7.81 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 126.346 1.859 . . . . 0.0 113.621 -171.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.22 54.9 16.35 Favored Pre-proline 0 CA--C 1.559 1.314 0 C-N-CA 126.746 2.018 . . . . 0.0 114.769 -176.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.42 89.47 0.94 Allowed 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.632 2.888 . . . . 0.0 111.324 179.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? 51.92 65.13 1.59 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 126.211 1.805 . . . . 0.0 112.362 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.9 t -116.35 95.68 45.92 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.404 1.482 . . . . 0.0 110.159 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -79.7 172.99 13.51 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 123.848 3.032 . . . . 0.0 112.879 172.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.7 p -130.04 72.3 1.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.429 1.492 . . . . 0.0 112.328 -161.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -108.15 19.2 20.24 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -171.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.58 41.27 0.62 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.852 2.061 . . . . 0.0 112.501 -176.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.6 t -129.45 9.48 5.57 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 125.191 1.396 . . . . 0.0 114.649 -164.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.65 12.35 41.41 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.338 1.447 . . . . 0.0 115.902 -175.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -123.18 48.32 1.84 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.516 1.526 . . . . 0.0 112.759 -168.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 62.56 70.94 0.54 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.981 2.112 . . . . 0.0 113.424 171.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.5 t -127.72 78.96 1.86 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.041 1.737 . . . . 0.0 111.585 -161.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 59.34 18.73 6.98 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.493 1.917 . . . . 0.0 116.105 166.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -144.58 -38.88 0.28 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.124 1.77 . . . . 0.0 110.916 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -67.03 -47.2 72.14 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.298 -0.876 . . . . 0.0 111.678 -178.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -65.78 -25.77 67.41 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.86 -1.15 . . . . 0.0 113.125 171.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -69.01 -11.04 60.42 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 169.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.0 mt -95.46 -51.49 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.114 1.365 . . . . 0.0 109.82 165.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.48 -60.05 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.569 0.748 . . . . 0.0 111.829 -169.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.0 -28.55 65.6 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.167 0.44 . . . . 0.0 111.659 -176.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.28 -43.44 87.98 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 165.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -38.36 88.97 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.173 0.897 . . . . 0.0 111.836 174.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.1 mm -57.05 -35.02 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 120.473 -1.392 . . . . 0.0 111.076 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -75.61 -8.41 56.7 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.385 1.624 . . . . 0.0 115.385 173.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.51 -53.43 4.06 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.473 1.488 . . . . 0.0 111.956 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.1 m -120.77 -13.93 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 -165.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.41 -75.25 0.43 Allowed Glycine 0 N--CA 1.469 0.854 0 C-N-CA 124.57 1.081 . . . . 0.0 112.998 164.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 51.4 tp -164.94 -43.57 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.656 1.182 . . . . 0.0 112.215 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -112.4 -5.35 14.11 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.944 1.298 . . . . 0.0 114.393 -168.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -92.93 -15.1 26.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.125 0.97 . . . . 0.0 113.212 -174.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -68.25 166.42 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 166.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -115.82 167.58 10.81 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 122.48 1.133 . . . . 0.0 111.789 170.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.38 -22.89 38.02 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.402 1.081 . . . . 0.0 112.577 -179.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -66.1 -49.57 67.09 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.777 1.631 . . . . 0.0 111.441 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -64.06 -43.79 94.4 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.049 -1.032 . . . . 0.0 111.917 178.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -55.98 -58.48 7.74 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.642 0.777 . . . . 0.0 111.386 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.7 p -61.36 -21.33 63.94 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -78.81 -43.15 25.93 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.897 1.279 . . . . 0.0 112.345 175.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -79.7 -34.12 40.45 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.945 1.298 . . . . 0.0 113.234 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.8 mt -87.31 -23.8 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.955 1.702 . . . . 0.0 113.548 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.17 49.16 9.54 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.083 1.353 . . . . 0.0 112.262 -174.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.9 pt -107.24 172.44 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 126.738 2.015 . . . . 0.0 110.712 169.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 m -71.38 137.93 48.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.283 1.433 . . . . 0.0 109.538 165.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -56.28 -38.83 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.778 0.831 . . . . 0.0 111.672 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -72.92 -22.18 60.77 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -75.23 -37.07 61.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.696 166.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.9 -47.81 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.387 0.54 . . . . 0.0 110.813 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -51.46 -37.17 47.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.313 1.845 . . . . 0.0 113.567 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.5 t -96.26 -30.64 13.34 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -63.85 -32.37 73.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.003 -1.061 . . . . 0.0 112.499 174.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 33.2 mt -50.92 -27.11 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.54 1.536 . . . . 0.0 112.791 173.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -115.34 -26.02 7.76 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 176.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -80.89 35.14 0.36 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.906 1.282 . . . . 0.0 112.542 171.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.1 t -157.47 -48.82 0.07 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.137 1.375 . . . . 0.0 112.727 177.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -135.62 28.43 3.3 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -161.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.6 ptt-85 -75.21 -10.72 59.72 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 -177.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 9.4 ttp -142.31 60.03 1.45 Allowed 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.618 0.723 . . . . 0.0 112.809 -169.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -81.19 -106.82 0.33 Allowed Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.523 1.058 . . . . 0.0 111.697 174.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -100.61 52.23 0.87 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.086 1.355 . . . . 0.0 112.354 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.5 p 52.76 19.46 1.28 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.531 1.678 . . . . 0.0 115.531 170.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 50.85 15.01 0.21 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.434 1.893 . . . . 0.0 115.193 -164.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -14.21 58.97 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 120.018 -1.676 . . . . 0.0 113.378 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -73.88 14.94 0.33 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.841 2.056 . . . . 0.0 114.167 176.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -81.43 5.05 18.82 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.835 2.454 . . . . 0.0 114.436 -173.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 51.5 m -144.55 -46.59 0.25 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 127.066 2.146 . . . . 0.0 110.097 -170.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.5 mt -70.72 159.65 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.938 1.295 . . . . 0.0 109.223 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.5 mmtp 67.73 0.85 2.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.655 1.982 . . . . 0.0 116.211 177.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.9 mtm -106.66 -42.63 4.92 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.22 -21.48 31.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.792 0.837 . . . . 0.0 113.117 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -86.13 137.85 32.36 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.246 1.818 . . . . 0.0 110.939 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -135.77 155.64 50.05 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.724 1.61 . . . . 0.0 112.0 -176.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -106.92 140.1 40.27 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.482 1.513 . . . . 0.0 111.553 172.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.0 t -129.53 -39.34 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 124.824 1.25 . . . . 0.0 111.028 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 77.5 p -121.2 15.21 11.43 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.187 1.795 . . . . 0.0 113.707 -178.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 7.8 t 58.04 86.52 0.08 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.108 1.763 . . . . 0.0 112.718 -171.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.67 171.24 15.41 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.415 1.486 . . . . 0.0 113.885 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.0 m -108.8 172.7 6.69 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.625 1.57 . . . . 0.0 110.632 176.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.55 -26.41 65.35 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -146.0 151.64 45.66 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 126.891 2.076 . . . . 0.0 110.69 167.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.32 129.46 18.11 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.143 2.562 . . . . 0.0 110.424 169.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -135.27 43.73 2.63 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.325 1.45 . . . . 0.0 111.641 -175.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 18.8 tp -132.71 66.41 76.5 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 125.032 1.333 . . . . 0.0 111.417 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.253 1.252 0 C-N-CA 123.939 3.093 . . . . 0.0 113.317 179.325 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.492 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.8 m -137.86 152.19 48.82 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.345 1.458 . . . . 0.0 111.579 -177.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 57.2 t60 -100.74 136.22 40.95 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.661 1.184 . . . . 0.0 111.176 177.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 94.2 mtp -133.61 102.12 5.37 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.185 1.394 . . . . 0.0 110.395 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.4 -65.27 0.43 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.801 1.24 . . . . 0.0 111.831 175.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 21.4 m 51.76 35.93 16.51 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.536 1.534 . . . . 0.0 114.584 178.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ptm -155.46 -33.29 0.09 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 -176.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -93.19 -10.26 36.4 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.011 1.324 . . . . 0.0 113.166 -175.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.49 19.47 3.35 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.402 1.881 . . . . 0.0 111.872 -168.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.0 mp -116.81 129.41 56.08 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.661 1.585 . . . . 0.0 110.342 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -145.68 5.88 1.05 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.438 1.095 . . . . 0.0 113.792 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -110.76 91.27 3.59 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.652 1.581 . . . . 0.0 110.279 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -132.36 104.53 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 125.029 1.331 . . . . 0.0 109.059 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.1 mp -138.36 128.27 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.341 1.456 . . . . 0.0 109.595 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 50.06 44.16 25.74 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.654 1.582 . . . . 0.0 113.468 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -141.06 172.09 13.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.871 1.668 . . . . 0.0 112.044 -173.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.326 14.9 tt 50.84 41.05 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 126.4 1.88 . . . . 0.0 114.391 168.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.52 169.03 12.56 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.955 1.302 . . . . 0.0 112.273 177.072 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -75.37 64.88 1.59 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.894 1.278 . . . . 0.0 111.26 169.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -75.77 97.77 3.96 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 124.934 1.294 . . . . 0.0 110.756 176.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.12 -70.94 0.38 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.125 0.97 . . . . 0.0 112.092 175.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 mt -118.63 3.43 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.629 1.572 . . . . 0.0 112.179 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -81.25 -7.22 59.53 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.4 t -101.18 -55.03 2.65 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.665 1.186 . . . . 0.0 112.991 178.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -71.7 -16.46 62.24 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -168.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 71.2 t -74.41 -26.96 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.861 1.264 . . . . 0.0 112.024 178.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.6 t -96.6 47.15 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.908 1.283 . . . . 0.0 111.408 -175.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.4 mt -138.63 145.02 39.99 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.217 1.807 . . . . 0.0 111.553 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -133.49 36.9 3.35 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.879 1.672 . . . . 0.0 112.764 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.0 t30 52.01 75.83 0.61 Allowed Pre-proline 0 CA--C 1.556 1.174 0 C-N-CA 126.799 2.04 . . . . 0.0 112.921 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.82 76.72 3.61 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 124.17 3.247 . . . . 0.0 112.925 -171.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.76 43.43 28.1 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 126.969 2.107 . . . . 0.0 113.421 174.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 43.1 t 41.77 89.51 0.08 OUTLIER Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 129.118 2.967 . . . . 0.0 113.321 -178.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -69.16 165.47 30.17 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 122.457 2.105 . . . . 0.0 113.45 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.7 p -128.96 71.9 1.44 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.331 1.452 . . . . 0.0 111.917 -155.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -127.85 17.23 6.81 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -170.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.63 72.22 6.79 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.797 1.639 . . . . 0.0 110.772 -170.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.4 t -141.68 11.6 2.07 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 114.795 1.405 . . . . 0.0 114.795 -170.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.0 -79.24 0.92 Allowed Glycine 0 CA--C 1.533 1.178 0 O-C-N 120.78 -1.2 . . . . 0.0 112.728 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 63.08 -3.05 0.37 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 127.996 2.519 . . . . 0.0 115.64 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp -144.13 141.44 29.99 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 127.098 2.159 . . . . 0.0 109.69 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.3 t -113.25 -73.09 0.68 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.268 1.827 . . . . 0.0 112.043 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -161.86 -45.86 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.28 0.632 . . . . 0.0 111.19 -171.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.69 -32.23 73.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.534 0.734 . . . . 0.0 111.124 173.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -67.79 -35.36 78.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.129 0.972 . . . . 0.0 111.601 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -69.69 -35.07 74.76 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.295 -0.878 . . . . 0.0 112.667 171.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.71 -5.98 3.2 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.27 -24.56 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.81 1.644 . . . . 0.0 112.382 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 51.2 t -112.75 -59.59 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 124.597 1.159 . . . . 0.0 112.598 -176.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.26 -33.11 73.99 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.269 -0.894 . . . . 0.0 111.893 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -68.71 -30.85 69.58 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.182 0.993 . . . . 0.0 113.208 171.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -76.65 -37.85 55.57 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.873 1.269 . . . . 0.0 111.623 177.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.47 -40.0 65.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 O-C-N 121.062 -1.023 . . . . 0.0 110.085 167.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -73.11 -6.22 44.24 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -110.03 -30.96 7.55 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.331 1.423 . . . . 0.0 113.261 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.1 p -135.2 -16.54 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -173.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.96 -83.49 0.28 Allowed Glycine 0 N--CA 1.469 0.886 0 C-N-CA 125.098 1.332 . . . . 0.0 111.683 171.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 tt -166.31 -44.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.082 1.753 . . . . 0.0 110.551 177.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -107.55 -6.73 16.81 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.224 1.81 . . . . 0.0 115.155 -168.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.36 -16.94 24.1 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.911 0.778 . . . . 0.0 112.862 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -63.46 163.76 10.37 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.181 1.392 . . . . 0.0 112.754 167.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -112.69 170.6 8.07 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.233 1.016 . . . . 0.0 111.47 170.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -21.66 31.72 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.424 1.089 . . . . 0.0 112.72 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -65.24 -45.35 85.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.809 1.643 . . . . 0.0 112.219 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -65.46 -36.48 84.0 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.556 -1.34 . . . . 0.0 111.993 176.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 47.2 mt -65.89 -47.25 75.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.182 0.593 . . . . 0.0 112.146 173.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.8 p -63.9 -31.05 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.11 -0.994 . . . . 0.0 113.036 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -71.47 -43.6 66.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.338 1.455 . . . . 0.0 112.834 176.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -94.78 -37.11 11.41 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -86.28 -15.36 40.95 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.446 1.499 . . . . 0.0 111.568 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 59.82 67.18 0.9 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.244 1.818 . . . . 0.0 112.657 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.1 pt -136.87 161.64 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 128.399 2.68 . . . . 0.0 109.022 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.3 t -68.4 153.17 44.29 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.364 -0.835 . . . . 0.0 110.751 167.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.99 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.679 0.792 . . . . 0.0 111.126 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.06 -31.5 70.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 27.7 mttm -64.93 -40.69 95.44 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.62 170.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.33 -49.18 65.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.651 0.66 . . . . 0.0 110.64 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -54.35 -42.47 70.29 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.438 1.495 . . . . 0.0 112.483 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -85.15 -38.06 19.47 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.509 0.595 . . . . 0.0 112.526 -178.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -61.74 -35.73 78.93 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.054 -1.029 . . . . 0.0 112.984 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.9 mt -47.69 -55.27 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.194 0.998 . . . . 0.0 110.719 172.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -77.4 -30.32 53.53 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -67.85 -35.02 77.83 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.098 1.317 . . . . 0.0 112.268 175.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.2 t -77.11 -45.91 25.33 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.337 1.055 . . . . 0.0 112.116 178.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -149.53 83.13 1.41 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.446 1.098 . . . . 0.0 112.164 -178.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.6 ttp85 -67.51 -61.84 1.7 Allowed 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.844 -1.16 . . . . 0.0 112.545 178.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 51.0 mtt -158.21 39.78 0.26 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.838 2.455 . . . . 0.0 110.242 -171.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -87.77 -125.77 2.26 Favored Glycine 0 CA--C 1.528 0.881 0 O-C-N 120.895 -1.128 . . . . 0.0 111.525 -175.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -94.89 34.43 1.36 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.075 1.75 . . . . 0.0 112.072 175.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 50.75 29.0 3.92 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.918 2.087 . . . . 0.0 113.263 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 44.75 36.73 1.93 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.095 1.758 . . . . 0.0 114.707 -168.322 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.27 -5.65 24.03 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.329 . . . . 0.0 113.851 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -71.63 17.25 0.09 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.634 1.974 . . . . 0.0 114.082 174.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.9 pttt -84.46 -10.4 57.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 128.056 2.542 . . . . 0.0 113.116 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 85.4 m -137.03 -42.7 0.57 Allowed 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.558 1.943 . . . . 0.0 111.24 -175.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.5 mt -71.19 153.42 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.829 0.852 . . . . 0.0 108.881 167.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm 66.68 -4.66 0.72 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 170.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -82.18 -26.89 32.99 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.939 0.79 . . . . 0.0 113.032 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -114.91 -10.67 12.29 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.063 1.345 . . . . 0.0 113.95 -175.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -94.79 149.6 21.07 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.406 1.482 . . . . 0.0 111.988 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -87.9 114.81 24.87 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.802 0.841 . . . . 0.0 110.691 172.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -138.18 145.5 41.57 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.85 1.66 . . . . 0.0 111.36 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 37.8 t -135.98 -50.1 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.681 1.192 . . . . 0.0 111.516 173.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 23.6 m -120.3 24.48 10.37 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.056 1.343 . . . . 0.0 113.324 -175.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t 54.25 49.78 17.84 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.634 1.574 . . . . 0.0 113.678 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.06 165.36 23.68 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.776 1.23 . . . . 0.0 113.275 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.5 t -139.12 -173.02 3.47 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.287 1.435 . . . . 0.0 110.514 176.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.44 56.71 0.68 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.892 1.677 . . . . 0.0 112.621 176.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -71.84 149.32 92.68 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.045 1.738 . . . . 0.0 112.366 -176.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.15 79.19 3.21 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 124.118 3.212 . . . . 0.0 111.283 177.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -140.44 95.41 2.87 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.763 1.625 . . . . 0.0 109.898 -176.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.1 tp -130.88 68.1 81.45 Favored Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 125.381 1.473 . . . . 0.0 111.363 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 C--O 1.254 1.313 0 C-N-CA 124.11 3.207 . . . . 0.0 113.269 179.384 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.581 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 11.2 t -146.79 145.84 30.05 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.103 1.361 . . . . 0.0 111.346 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -148.06 33.16 0.82 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.665 1.186 . . . . 0.0 112.584 -170.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.4 mmt -97.67 76.32 2.49 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.054 1.342 . . . . 0.0 111.377 -172.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.67 73.2 0.33 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.646 1.979 . . . . 0.0 113.735 -178.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 57.5 p -49.42 -34.3 16.15 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.07 2.148 . . . . 0.0 114.76 -174.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.8 mtp -67.47 -10.69 53.88 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.389 1.476 . . . . 0.0 114.276 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -123.57 9.72 9.02 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 127.81 2.444 . . . . 0.0 112.097 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.58 20.66 2.02 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.288 1.835 . . . . 0.0 111.887 -163.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 mp -118.58 120.9 38.84 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.61 1.564 . . . . 0.0 110.839 176.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -147.17 2.58 0.77 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.136 1.374 . . . . 0.0 113.343 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -119.47 89.33 3.11 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.156 1.782 . . . . 0.0 109.704 -174.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 28.8 mm -123.57 136.41 60.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.802 1.641 . . . . 0.0 109.52 -174.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.7 mm -96.25 128.92 47.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.207 1.003 . . . . 0.0 110.657 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -139.08 14.26 2.64 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.98 1.312 . . . . 0.0 112.596 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -85.37 169.5 13.63 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -173.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 10.7 tt -93.86 12.61 3.09 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 126.534 1.934 . . . . 0.0 114.115 178.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -141.31 158.37 43.98 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.602 1.561 . . . . 0.0 112.357 -169.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -89.83 36.8 0.86 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.256 1.423 . . . . 0.0 113.162 -177.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -144.18 145.82 32.33 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.635 1.574 . . . . 0.0 111.703 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.83 -96.3 0.11 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.391 1.876 . . . . 0.0 110.192 -166.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.5 mp -136.54 54.29 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.499 1.919 . . . . 0.0 107.862 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -128.28 8.45 6.04 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.779 1.632 . . . . 0.0 112.217 174.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.3 t -134.64 -54.02 0.82 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.492 1.117 . . . . 0.0 112.742 -176.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -60.27 -22.68 63.4 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 175.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.6 p -85.5 -13.51 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.72 2.008 . . . . 0.0 113.302 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.2 t -129.98 52.63 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 125.732 1.613 . . . . 0.0 109.99 173.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.7 tp -89.06 155.85 19.21 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.449 1.1 . . . . 0.0 111.849 178.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.9 24.49 9.6 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.691 1.596 . . . . 0.0 114.883 -171.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.5 t30 51.02 74.46 0.8 Allowed Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 126.452 1.901 . . . . 0.0 113.022 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.74 94.86 0.28 Allowed 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.741 2.961 . . . . 0.0 113.006 -171.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.1 mmt85 -137.55 -43.21 0.54 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.924 2.09 . . . . 0.0 112.69 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.9 t -126.41 86.34 58.45 Favored Pre-proline 0 N--CA 1.479 1.005 0 C-N-CA 124.338 1.055 . . . . 0.0 111.134 -178.175 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -76.16 173.06 15.11 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.639 2.893 . . . . 0.0 113.155 172.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.8 p -119.94 68.32 0.83 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.073 1.749 . . . . 0.0 112.804 -164.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -113.39 30.04 7.52 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.288 1.435 . . . . 0.0 113.41 -174.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.9 39.91 0.19 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.337 1.855 . . . . 0.0 113.924 -174.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.8 t -117.93 -5.34 11.03 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.778 1.631 . . . . 0.0 114.901 -171.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.22 -54.06 7.22 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.623 1.106 . . . . 0.0 113.148 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.07 32.97 22.68 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.883 1.673 . . . . 0.0 114.318 175.034 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.23 96.1 6.18 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.038 1.735 . . . . 0.0 111.317 -170.72 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.2 m -134.05 71.36 1.45 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.662 1.985 . . . . 0.0 111.3 -173.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 66.44 8.76 5.97 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 163.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -128.44 -32.6 2.18 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.27 1.028 . . . . 0.0 111.903 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -76.1 -42.71 46.33 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.978 1.311 . . . . 0.0 111.407 -170.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.25 -31.02 72.06 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.179 0.992 . . . . 0.0 112.846 166.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -68.21 -3.48 10.8 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 169.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -103.54 -55.96 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.287 1.435 . . . . 0.0 109.579 166.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.8 t -74.18 -50.69 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 CA-C-N 119.308 0.958 . . . . 0.0 113.075 -170.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.09 -34.72 78.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.88 0.764 . . . . 0.0 111.084 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.05 -35.52 77.15 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 170.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.51 -39.72 70.6 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.182 -0.949 . . . . 0.0 111.521 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -36.82 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 O-C-N 120.601 -1.312 . . . . 0.0 110.944 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.8 m -70.83 -11.49 60.99 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 171.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -104.48 -42.24 5.5 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.318 1.417 . . . . 0.0 112.873 -172.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.9 m -128.81 -13.36 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.49 -79.2 0.34 Allowed Glycine 0 N--CA 1.47 0.923 0 C-N-CA 125.075 1.322 . . . . 0.0 112.504 164.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 tp -159.8 -47.33 0.05 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.371 1.068 . . . . 0.0 112.143 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -106.34 -13.39 15.39 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.684 1.594 . . . . 0.0 114.307 -170.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -87.16 -11.04 51.15 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -171.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.4 pp -69.9 175.1 4.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.166 1.786 . . . . 0.0 113.975 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -117.68 120.85 39.26 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.083 0.953 . . . . 0.0 111.964 -178.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.11 -24.91 68.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.289 0.636 . . . . 0.0 112.641 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.0 m -69.38 -43.6 73.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.9 1.28 . . . . 0.0 112.1 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -63.51 -38.51 91.4 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.266 -1.521 . . . . 0.0 111.763 173.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.73 -51.29 69.98 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.775 0.43 . . . . 0.0 111.633 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 98.6 p -65.26 -26.8 68.25 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -74.17 -46.44 42.23 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.608 1.563 . . . . 0.0 112.07 175.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.3 mmt-85 -72.8 -42.9 63.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.846 1.258 . . . . 0.0 113.127 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -92.38 -20.34 21.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.102 1.761 . . . . 0.0 112.249 -170.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 62.25 68.17 0.69 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.279 1.832 . . . . 0.0 112.844 -178.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.5 pt -132.35 173.97 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 128.55 2.74 . . . . 0.0 108.527 174.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.7 t -78.36 152.94 32.04 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 121.126 -0.983 . . . . 0.0 110.573 165.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.6 t -57.49 -36.45 53.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.093 0.957 . . . . 0.0 111.134 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.46 -33.8 75.87 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -69.2 -33.45 73.37 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.049 -0.976 . . . . 0.0 111.396 172.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -49.67 54.26 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.548 1.067 . . . . 0.0 110.679 174.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -55.15 -39.23 69.25 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.439 1.496 . . . . 0.0 112.796 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.6 t -83.88 -41.16 17.73 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -59.93 -34.32 73.08 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 120.862 -1.149 . . . . 0.0 112.835 -179.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.09 -64.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.657 1.183 . . . . 0.0 110.408 171.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.71 -21.98 60.96 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -179.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -79.99 -31.44 39.75 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.081 0.855 . . . . 0.0 112.725 -178.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -94.22 -45.3 7.58 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.159 1.384 . . . . 0.0 112.89 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -126.19 81.27 1.98 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.052 1.341 . . . . 0.0 112.324 -175.185 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.02 -4.03 50.3 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 125.568 1.547 . . . . 0.0 114.554 171.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 69.3 mtm -81.81 59.69 4.36 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.058 1.343 . . . . 0.0 112.731 -172.703 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -88.49 -114.29 1.24 Allowed Glycine 0 CA--C 1.53 1.031 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 169.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.9 mtt85 -109.31 61.55 0.6 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.513 1.525 . . . . 0.0 111.999 172.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.3 p 53.03 23.35 2.89 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 165.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 48.94 25.98 1.21 Allowed 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 125.83 1.652 . . . . 0.0 114.77 -166.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.52 -8.81 28.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.493 1.517 . . . . 0.0 113.805 -178.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -70.9 15.36 0.11 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.367 2.267 . . . . 0.0 115.569 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -77.39 1.87 17.69 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 126.703 2.001 . . . . 0.0 114.756 -172.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.4 m -147.6 -48.89 0.17 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.707 2.003 . . . . 0.0 110.297 -170.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.7 mt -71.31 156.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.649 1.18 . . . . 0.0 109.533 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? 68.23 -4.92 0.97 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.991 2.116 . . . . 0.0 116.118 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.7 mtm -102.99 -43.09 5.61 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -94.11 -9.07 37.74 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -97.21 150.47 20.87 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.325 1.45 . . . . 0.0 112.222 -175.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -138.34 152.52 48.54 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.63 1.572 . . . . 0.0 111.173 176.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -143.17 148.71 36.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.023 1.329 . . . . 0.0 112.1 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.4 t -135.39 -47.24 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.957 1.303 . . . . 0.0 111.205 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.1 m -119.75 26.48 9.31 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.411 1.484 . . . . 0.0 113.169 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.8 t 55.99 38.14 29.62 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.824 1.65 . . . . 0.0 114.328 -179.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.37 125.75 29.83 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.179 -0.951 . . . . 0.0 111.805 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.6 m -145.55 118.5 8.77 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.447 1.499 . . . . 0.0 109.876 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.14 24.48 4.89 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.716 1.606 . . . . 0.0 115.176 -177.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -124.58 98.33 37.71 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 125.833 1.653 . . . . 0.0 110.99 -177.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.05 64.52 8.87 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 124.324 3.349 . . . . 0.0 111.641 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.08 38.83 3.56 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.861 1.664 . . . . 0.0 112.023 -172.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 90.7 mt -133.68 150.62 75.29 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.858 1.663 . . . . 0.0 111.495 -179.209 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.235 0 C-N-CA 124.088 3.192 . . . . 0.0 113.426 179.024 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 112.117 -0.393 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 12.2 t -147.5 158.2 43.89 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.501 1.52 . . . . 0.0 111.245 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -118.93 119.19 33.59 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.908 1.283 . . . . 0.0 111.055 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 60.9 mtt -135.4 113.11 10.88 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.174 1.39 . . . . 0.0 110.091 175.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -144.31 -63.78 0.37 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.752 1.221 . . . . 0.0 111.565 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 20.3 m 53.07 31.63 11.56 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.682 1.593 . . . . 0.0 114.93 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.94 -25.64 0.12 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -93.63 -7.51 43.7 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.431 1.492 . . . . 0.0 113.306 -178.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.05 33.75 1.55 Allowed 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.856 1.663 . . . . 0.0 111.587 -164.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.5 mp -104.33 87.43 2.73 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.398 1.479 . . . . 0.0 110.22 -178.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -127.69 -0.81 6.1 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.173 1.389 . . . . 0.0 113.804 -176.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -102.73 89.1 3.38 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.905 1.282 . . . . 0.0 111.971 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 mp -134.57 -47.94 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 178.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 20.2 tt -150.04 149.23 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.955 1.302 . . . . 0.0 111.52 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.7 mp0 -113.0 148.32 35.32 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.456 1.503 . . . . 0.0 111.55 177.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -150.92 156.27 40.85 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.915 1.286 . . . . 0.0 111.172 -177.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.7 pt -85.25 77.07 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.826 1.25 . . . . 0.0 112.777 -176.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -152.21 156.62 40.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.395 1.478 . . . . 0.0 111.734 -174.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -92.85 61.5 3.55 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.697 1.199 . . . . 0.0 111.454 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -134.3 138.11 44.74 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.218 1.007 . . . . 0.0 111.155 174.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.42 -77.45 0.31 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.615 1.566 . . . . 0.0 110.967 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 69.8 mt -121.86 -10.06 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.792 1.237 . . . . 0.0 113.597 -174.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -74.0 -16.13 61.08 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -172.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.1 t -88.71 -53.34 4.67 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.305 1.042 . . . . 0.0 112.136 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -71.08 -18.01 62.57 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.6 t -87.12 -26.83 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.097 1.359 . . . . 0.0 111.963 175.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.6 t -132.08 79.83 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 125.232 1.413 . . . . 0.0 110.155 -174.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.8 tp -132.58 147.97 52.36 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.144 1.378 . . . . 0.0 111.955 -177.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -121.65 42.15 3.17 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.572 1.549 . . . . 0.0 113.322 -175.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 t30 49.8 64.61 8.2 Favored Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 126.469 1.907 . . . . 0.0 114.247 176.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.28 88.53 0.48 Allowed 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.923 3.082 . . . . 0.0 112.159 -176.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -127.25 -50.55 1.42 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.151 1.78 . . . . 0.0 113.501 -178.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 44.6 t 48.25 83.37 0.22 Allowed Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 127.802 2.441 . . . . 0.0 112.978 175.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -66.59 158.86 53.65 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.494 2.796 . . . . 0.0 113.446 -178.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.2 t -113.88 79.73 1.29 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.739 1.615 . . . . 0.0 111.502 -169.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -104.56 32.6 3.98 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.821 1.649 . . . . 0.0 112.781 -178.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.72 33.76 0.08 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 127.152 2.181 . . . . 0.0 115.024 -173.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.0 t -138.23 13.5 2.82 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.137 1.375 . . . . 0.0 114.414 -162.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -146.26 25.82 1.71 Allowed Glycine 0 CA--C 1.535 1.336 0 O-C-N 120.788 -1.195 . . . . 0.0 115.793 -172.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -76.11 -53.19 8.68 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.746 1.273 . . . . 0.0 113.365 -173.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp -145.19 141.84 29.05 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.969 2.108 . . . . 0.0 108.968 174.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.5 m -120.46 -66.76 1.03 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.802 1.641 . . . . 0.0 112.162 177.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -163.6 -48.91 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.0 110.453 -170.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.61 72.89 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.937 177.514 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -68.92 -34.42 75.36 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.185 0.994 . . . . 0.0 111.921 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -69.63 -33.62 72.9 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.88 -1.138 . . . . 0.0 111.847 171.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -67.09 -1.16 3.9 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 170.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.1 mt -112.53 -26.86 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.523 1.929 . . . . 0.0 112.44 171.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.2 t -107.95 -59.91 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.749 1.159 . . . . 0.0 112.378 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.37 93.81 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.767 0.827 . . . . 0.0 111.701 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -66.47 -38.44 87.33 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -71.38 -32.05 68.01 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.619 1.168 . . . . 0.0 112.677 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.56 -31.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.08 0.952 . . . . 0.0 111.768 167.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 t -74.71 -17.16 60.7 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.479 0.712 . . . . 0.0 112.86 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -90.61 -44.21 9.68 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.223 -0.923 . . . . 0.0 111.318 176.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 84.9 t -108.12 -48.85 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -167.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.34 -79.84 0.18 Allowed Glycine 0 N--CA 1.469 0.894 0 CA-C-N 118.182 0.446 . . . . 0.0 114.053 170.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 tt -172.63 -39.3 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.805 1.642 . . . . 0.0 113.331 -173.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -121.62 -9.69 8.89 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.616 1.567 . . . . 0.0 114.984 -168.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -3.29 28.09 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -172.509 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.38 157.43 37.06 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.59 1.956 . . . . 0.0 113.961 -170.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -85.38 104.93 15.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.214 1.006 . . . . 0.0 109.726 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.78 -24.39 61.72 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.347 0.659 . . . . 0.0 112.349 171.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -58.67 -46.03 88.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.426 1.89 . . . . 0.0 112.405 169.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -63.63 -37.64 88.11 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.307 -1.495 . . . . 0.0 112.423 175.57 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.19 -49.82 70.53 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.566 0.621 . . . . 0.0 112.174 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.1 p -64.53 -22.96 67.11 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.235 -0.916 . . . . 0.0 113.468 -179.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -81.76 -14.47 56.41 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.608 1.563 . . . . 0.0 113.751 175.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -119.99 -42.18 2.61 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.227 1.411 . . . . 0.0 113.582 -172.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.1 mp -85.85 -12.01 51.88 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.868 1.267 . . . . 0.0 112.603 172.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.67 63.97 1.55 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.313 1.445 . . . . 0.0 111.905 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -128.22 167.19 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 126.937 2.095 . . . . 0.0 111.45 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.8 m -63.86 141.46 58.76 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.72 1.208 . . . . 0.0 109.721 167.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.74 -36.94 68.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.251 -0.905 . . . . 0.0 111.437 -178.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -72.83 -28.71 62.71 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 177.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -66.05 -40.07 90.63 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.524 -0.75 . . . . 0.0 110.519 168.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.75 -47.82 73.95 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.91 0.777 . . . . 0.0 111.14 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.51 -38.69 69.53 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.451 1.5 . . . . 0.0 112.942 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -88.76 -34.95 16.94 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.96 -34.91 79.05 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.73 1.212 . . . . 0.0 112.884 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.6 mt -50.29 -36.36 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.735 1.214 . . . . 0.0 112.096 173.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -92.01 -43.95 9.14 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.969 0.908 . . . . 0.0 112.799 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 -68.24 -23.54 64.8 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -172.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.1 t -84.89 -37.45 20.59 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.232 1.013 . . . . 0.0 113.509 173.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -145.45 54.23 1.19 Allowed 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -168.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -58.23 -30.96 66.93 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -172.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 61.1 mtm -127.74 -9.87 5.56 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.342 1.457 . . . . 0.0 113.889 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.51 132.49 7.28 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.234 1.397 . . . . 0.0 112.116 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 48.3 33.15 3.58 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 125.945 1.698 . . . . 0.0 113.71 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 46.88 30.66 1.27 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.308 2.243 . . . . 0.0 113.818 -174.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 56.5 7.92 0.4 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 126.72 2.008 . . . . 0.0 115.543 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -12.44 59.99 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 119.992 -1.692 . . . . 0.0 113.906 -173.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -72.61 13.15 0.39 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 127.085 2.154 . . . . 0.0 114.835 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -91.32 -4.3 55.96 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.727 2.411 . . . . 0.0 114.64 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 63.6 m -138.61 -49.36 0.53 Allowed 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.994 1.718 . . . . 0.0 110.343 -172.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 44.1 pt -70.44 164.67 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.49 1.116 . . . . 0.0 111.873 176.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 65.14 -9.54 0.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 127.263 2.225 . . . . 0.0 116.346 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 46.0 mtm -93.29 -39.49 10.94 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.781 1.173 . . . . 0.0 113.945 -175.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -120.69 0.84 10.49 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -173.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -81.85 109.02 15.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.477 1.111 . . . . 0.0 111.149 -175.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -142.76 156.68 45.03 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.002 1.721 . . . . 0.0 111.547 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -110.6 142.28 42.66 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.184 1.393 . . . . 0.0 111.724 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -131.71 -42.56 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.727 1.211 . . . . 0.0 111.627 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 18.1 t -65.77 -35.57 81.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.616 0.766 . . . . 0.0 112.32 177.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 65.3 m -100.48 113.41 26.18 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.706 1.602 . . . . 0.0 110.542 171.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -150.87 154.03 36.46 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.306 1.443 . . . . 0.0 111.577 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.2 m -142.87 136.78 29.02 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.963 1.305 . . . . 0.0 111.064 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 55.1 16.14 1.47 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.051 1.74 . . . . 0.0 115.596 -177.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -83.05 126.6 72.05 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 124.294 1.037 . . . . 0.0 111.103 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -82.81 56.07 5.5 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.265 3.31 . . . . 0.0 112.504 -175.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -119.46 69.44 0.83 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.559 1.544 . . . . 0.0 111.552 -171.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 93.7 mt -125.7 87.81 55.25 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.8 1.64 . . . . 0.0 110.212 177.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo . . . . . 0 C--O 1.252 1.191 0 C-N-CA 123.915 3.077 . . . . 0.0 113.313 -179.509 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.642 0 N-CA-C 111.566 -0.613 . . . . 0.0 111.566 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 4.4 t -135.06 48.05 2.3 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.82 1.248 . . . . 0.0 112.329 -176.125 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 51.93 43.46 30.22 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.112 1.765 . . . . 0.0 113.409 -179.762 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 80.9 mtp -75.46 111.45 10.77 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.851 1.261 . . . . 0.0 110.145 -178.094 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -143.73 -49.53 0.3 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.215 1.006 . . . . 0.0 113.024 -176.544 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 8.0 t 63.34 -39.1 0.18 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.831 2.852 . . . . 0.0 117.242 176.427 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.6 ptt? -114.26 0.39 14.16 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 -174.471 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -118.77 1.68 11.59 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.426 1.49 . . . . 0.0 114.038 -177.426 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -122.86 13.91 9.93 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.004 1.483 . . . . 0.0 115.004 -171.278 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -83.9 -47.11 11.39 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.051 0.94 . . . . 0.0 113.118 -177.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -105.53 -22.99 12.88 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -173.354 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -115.16 127.79 55.77 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.864 1.665 . . . . 0.0 109.1 172.073 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.1 mp -134.83 120.0 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.684 1.194 . . . . 0.0 109.523 -172.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.1 mm -136.06 142.41 38.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 126.341 1.856 . . . . 0.0 109.578 -173.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 51.24 60.66 3.71 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.857 1.663 . . . . 0.0 113.675 176.465 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -126.09 -61.21 1.24 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.465 1.106 . . . . 0.0 112.816 -177.384 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 10.3 pt -135.68 111.81 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.247 1.419 . . . . 0.0 110.915 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.5 pm0 -156.06 -176.96 6.23 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.963 2.105 . . . . 0.0 109.73 177.532 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -58.86 -21.07 56.21 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -170.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -146.59 152.54 39.09 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.046 1.738 . . . . 0.0 110.606 173.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.56 -76.41 0.56 Allowed 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.782 1.233 . . . . 0.0 111.108 176.388 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.1 mt -127.87 -12.05 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -174.388 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 -79.86 -11.44 59.81 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -175.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.2 p -88.08 -49.32 7.11 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.781 1.232 . . . . 0.0 112.92 -176.843 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -66.79 -16.31 64.18 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -175.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.6 t -73.39 -26.17 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.567 1.547 . . . . 0.0 111.843 174.015 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.7 t -130.06 64.26 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.777 1.631 . . . . 0.0 109.4 -177.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.6 tp -136.39 148.84 48.02 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.129 1.372 . . . . 0.0 111.915 -174.075 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -112.53 53.41 0.74 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.385 1.874 . . . . 0.0 111.323 -172.123 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 44.63 77.52 0.45 Allowed Pre-proline 0 CA--C 1.554 1.109 0 C-N-CA 127.017 2.127 . . . . 0.0 114.691 171.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -75.02 80.0 2.54 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.562 2.841 . . . . 0.0 112.968 -173.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -131.25 -58.02 1.01 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.721 1.608 . . . . 0.0 112.868 174.877 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.4 t -136.86 78.93 40.58 Favored Pre-proline 0 N--CA 1.481 1.116 0 C-N-CA 124.487 1.115 . . . . 0.0 111.117 -174.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -74.0 168.03 25.77 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.036 2.49 . . . . 0.0 112.814 170.703 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.6 p -106.53 50.13 0.78 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.645 1.978 . . . . 0.0 113.63 -169.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.67 17.01 0.96 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 116.513 2.042 . . . . 0.0 116.513 -172.816 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -81.34 62.81 5.41 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.766 2.027 . . . . 0.0 112.239 -171.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.2 t -138.43 4.35 2.4 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -172.076 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 161.11 69.05 0.02 OUTLIER Glycine 0 N--CA 1.472 1.083 0 O-C-N 120.889 -1.132 . . . . 0.0 114.121 178.393 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -129.93 -90.82 0.46 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.222 1.009 . . . . 0.0 110.998 178.181 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -105.2 99.49 9.1 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.067 1.347 . . . . 0.0 110.348 -176.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.5 t -92.06 -69.79 0.72 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.312 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -161.8 -29.95 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.64 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -99.39 0.07 41.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.996 1.318 . . . . 0.0 112.311 177.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -106.39 -37.11 6.61 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.189 0.904 . . . . 0.0 112.87 175.603 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -65.15 -29.41 70.24 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.776 -1.202 . . . . 0.0 112.515 174.331 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -65.66 -6.38 11.16 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.829 1.252 . . . . 0.0 114.147 170.263 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.0 mp -104.89 -55.81 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 125.52 1.528 . . . . 0.0 110.116 167.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.9 t -65.05 -55.93 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 119.435 1.016 . . . . 0.0 111.613 -172.324 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.96 65.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -175.397 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -34.4 73.8 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.645 -0.659 . . . . 0.0 112.572 166.849 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.72 -37.95 70.57 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.25 0.932 . . . . 0.0 111.796 172.711 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -60.16 -31.16 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 120.491 -1.381 . . . . 0.0 110.899 173.053 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 t -74.28 -13.17 60.73 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 171.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -102.05 -43.98 5.6 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.529 -1.357 . . . . 0.0 112.959 -167.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.06 -11.7 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -169.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 135.47 -86.44 0.25 Allowed Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.767 1.175 . . . . 0.0 111.462 170.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -162.56 -44.74 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.599 1.56 . . . . 0.0 111.109 176.598 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -104.24 -13.44 16.18 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.516 1.526 . . . . 0.0 114.596 -168.591 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -85.99 -16.28 38.82 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.112 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -66.33 159.78 26.03 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.981 1.312 . . . . 0.0 113.815 179.12 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -104.23 117.97 35.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.225 1.01 . . . . 0.0 110.747 178.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.56 -24.4 66.62 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.519 1.127 . . . . 0.0 113.63 178.84 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.6 m -68.22 -40.72 81.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.041 0.936 . . . . 0.0 111.769 173.638 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -68.01 -29.19 68.13 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.353 -1.467 . . . . 0.0 113.007 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.64 -57.71 7.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.932 0.893 . . . . 0.0 111.345 165.616 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.0 p -60.44 -24.64 65.36 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.38 1.072 . . . . 0.0 113.657 -174.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -67.98 -24.51 65.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.496 1.918 . . . . 0.0 114.257 173.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 mtm-85 -112.65 -37.08 5.01 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.818 1.647 . . . . 0.0 113.411 -179.672 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -73.8 -17.83 61.03 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.108 0.963 . . . . 0.0 112.45 171.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 57.69 49.9 11.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.64 1.576 . . . . 0.0 111.626 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.0 pt -113.98 175.37 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 127.254 2.222 . . . . 0.0 110.952 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.4 m -71.96 137.57 47.41 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.726 1.61 . . . . 0.0 108.854 165.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.5 t -57.04 -40.13 70.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 O-C-N 121.782 -0.574 . . . . 0.0 111.139 -178.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.18 -26.95 63.19 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.335 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -68.23 -39.33 82.34 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.739 168.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.05 -49.09 73.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.461 1.028 . . . . 0.0 110.433 175.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -54.55 -41.42 69.76 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.492 1.517 . . . . 0.0 112.866 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -87.08 -33.32 19.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 177.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -61.91 -38.94 90.26 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.072 -1.017 . . . . 0.0 112.508 178.072 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.7 mt -46.86 -58.04 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.093 1.357 . . . . 0.0 110.358 173.581 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -72.89 -33.21 65.9 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.413 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -67.52 -33.31 74.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.202 0.91 . . . . 0.0 113.181 -178.704 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.6 m -91.25 -36.98 13.59 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 175.193 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -143.65 89.92 2.11 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.734 0.814 . . . . 0.0 112.411 -178.432 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.49 -0.78 51.85 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 115.07 1.508 . . . . 0.0 115.07 167.714 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 23.8 ptp -84.63 21.01 1.6 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -170.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.12 -57.57 3.17 Favored Glycine 0 N--CA 1.474 1.227 0 O-C-N 120.989 -1.07 . . . . 0.0 114.233 -170.126 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -140.37 53.08 1.64 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.522 1.529 . . . . 0.0 110.827 170.612 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.8 p 53.82 23.8 4.05 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 167.546 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 48.55 27.31 1.42 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.317 1.847 . . . . 0.0 114.388 -168.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.8 -10.33 24.97 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.738 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -70.72 10.72 0.46 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.197 2.199 . . . . 0.0 116.38 -169.302 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -87.1 -9.56 55.04 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.322 1.849 . . . . 0.0 114.817 -169.897 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.1 m -140.56 -44.09 0.4 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.778 1.631 . . . . 0.0 110.61 -165.599 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.0 pt -62.59 169.4 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 124.402 1.081 . . . . 0.0 111.697 169.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt 69.13 -19.99 0.17 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.574 1.949 . . . . 0.0 115.95 176.293 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 17.1 ptp -124.44 6.99 8.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.437 1.495 . . . . 0.0 113.79 -175.699 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -146.89 -30.51 0.35 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.27 1.428 . . . . 0.0 113.331 -167.588 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -124.0 160.69 27.07 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.148 1.779 . . . . 0.0 112.41 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -140.54 151.17 44.54 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.339 1.456 . . . . 0.0 111.969 -173.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -132.18 142.23 49.37 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.528 1.531 . . . . 0.0 111.754 -179.295 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.1 t -128.45 -48.15 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.714 1.205 . . . . 0.0 111.637 -179.296 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.9 m -120.5 17.38 12.11 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.293 1.437 . . . . 0.0 113.223 -177.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.5 t 62.47 152.95 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.273 2.229 . . . . 0.0 114.67 -166.065 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -149.81 128.0 12.04 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.23 1.412 . . . . 0.0 111.051 176.399 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 69.9 m -146.45 159.23 43.67 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.806 1.642 . . . . 0.0 111.072 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.4 34.08 0.31 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.532 1.533 . . . . 0.0 113.455 178.629 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 58.67 161.56 0.09 OUTLIER Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 129.026 2.93 . . . . 0.0 115.004 -171.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -64.61 108.93 1.13 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.746 2.297 . . . . 0.0 110.988 175.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -130.7 45.84 2.75 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.052 1.741 . . . . 0.0 110.422 -174.331 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 96.9 mt -118.79 150.85 49.22 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.177 1.791 . . . . 0.0 111.761 -174.375 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.057 3.172 . . . . 0.0 113.417 179.371 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 N-CA-C 112.054 -0.418 . . . . 0.0 112.054 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 49.5 m -86.3 138.87 31.5 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.47 1.108 . . . . 0.0 112.139 179.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -149.31 114.62 5.51 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.533 1.133 . . . . 0.0 110.386 178.791 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 86.5 mmm -135.4 93.22 2.94 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.253 1.421 . . . . 0.0 109.942 -178.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -144.92 -73.59 0.25 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.534 1.134 . . . . 0.0 112.315 -178.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 54.97 20.92 3.4 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 179.107 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? -144.29 -12.1 0.62 Allowed 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 177.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -111.42 -8.33 14.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.959 1.304 . . . . 0.0 114.149 -178.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -108.71 -10.61 15.15 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -173.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.1 mp -75.32 138.74 42.0 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.327 0.651 . . . . 0.0 111.362 -171.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -140.5 -3.45 1.32 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.498 1.119 . . . . 0.0 113.918 -179.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -98.33 89.04 4.32 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.186 1.395 . . . . 0.0 110.62 177.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.2 mp -132.05 124.5 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.306 1.442 . . . . 0.0 109.024 177.235 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.2 mt -136.09 49.67 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 125.187 1.395 . . . . 0.0 110.061 -176.565 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -136.33 155.05 50.61 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.456 1.502 . . . . 0.0 111.67 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.89 29.07 2.1 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.694 1.198 . . . . 0.0 114.189 -175.403 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.2 pt -131.52 123.41 52.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.894 1.678 . . . . 0.0 110.79 -179.153 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -125.17 -97.4 0.43 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.639 1.576 . . . . 0.0 110.477 179.785 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -150.71 63.68 0.93 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 126.139 1.776 . . . . 0.0 110.502 179.314 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -81.7 53.32 2.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.934 1.294 . . . . 0.0 113.436 -170.304 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -103.31 5.11 37.17 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -174.194 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mp -106.02 -0.68 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 125.985 1.714 . . . . 0.0 112.894 -171.457 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -96.9 7.05 47.48 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -174.476 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.2 t -137.07 -23.0 1.16 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -174.095 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -89.6 -13.21 37.67 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.595 1.958 . . . . 0.0 115.249 -173.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.6 t -91.98 -27.97 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.96 1.304 . . . . 0.0 112.23 -174.585 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.23 47.05 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 125.013 1.325 . . . . 0.0 111.854 -168.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.8 mt -135.83 129.32 32.24 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.649 1.579 . . . . 0.0 111.763 178.119 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -136.23 16.05 3.23 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 126.131 1.773 . . . . 0.0 114.6 -174.106 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 t30 50.08 70.73 1.87 Allowed Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 126.527 1.931 . . . . 0.0 112.725 -176.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -77.94 74.5 5.23 Favored 'Trans proline' 0 CA--C 1.546 1.083 0 C-N-CA 124.302 3.335 . . . . 0.0 113.342 -168.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 55.9 mtm-85 -134.46 -58.96 0.82 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.61 1.564 . . . . 0.0 113.094 173.089 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.1 t -141.65 107.53 5.98 Favored Pre-proline 0 N--CA 1.476 0.863 0 C-N-CA 125.109 1.364 . . . . 0.0 109.578 -178.811 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -73.39 162.08 41.07 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.361 2.707 . . . . 0.0 112.008 169.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 t -137.1 101.81 4.66 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.942 1.297 . . . . 0.0 109.786 -174.667 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -131.42 18.48 4.83 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 -168.19 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.5 ttpt -93.96 69.26 3.88 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.791 1.636 . . . . 0.0 111.88 -169.118 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -144.31 24.35 1.6 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.917 1.287 . . . . 0.0 113.616 -168.323 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.24 10.56 27.61 Favored Glycine 0 CA--C 1.541 1.701 0 O-C-N 120.315 -1.49 . . . . 0.0 115.838 -177.056 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -86.54 -0.48 56.19 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -168.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.7 mp -122.59 124.9 44.56 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 125.164 1.386 . . . . 0.0 110.46 179.783 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -104.74 -75.07 0.63 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.894 1.678 . . . . 0.0 111.648 -178.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -158.83 -40.65 0.06 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.61 -31.5 71.57 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 122.178 -0.326 . . . . 0.0 110.897 172.348 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -71.01 -44.81 65.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.644 0.778 . . . . 0.0 112.004 -171.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt -71.41 -22.54 61.85 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.54 -1.35 . . . . 0.0 112.977 175.625 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -70.87 1.48 5.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.997 1.319 . . . . 0.0 113.973 164.814 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 mt -115.31 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.136 1.774 . . . . 0.0 110.319 168.652 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.26 -62.3 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.047 1.294 . . . . 0.0 112.069 -178.613 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.36 -33.19 74.7 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.646 -0.659 . . . . 0.0 110.991 -177.183 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.29 -23.3 65.59 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 169.608 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.67 -40.73 17.06 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.461 1.028 . . . . 0.0 111.216 172.738 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.61 -35.44 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.995 -1.065 . . . . 0.0 111.499 176.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.8 p -76.8 -5.21 47.32 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 174.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -98.76 -54.17 3.08 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.331 1.423 . . . . 0.0 112.055 177.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -115.58 -16.36 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -166.109 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.65 -78.88 0.36 Allowed Glycine 0 N--CA 1.467 0.717 0 C-N-CA 125.494 1.521 . . . . 0.0 111.579 167.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -165.94 -45.24 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.842 1.257 . . . . 0.0 112.141 174.148 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -97.33 -14.9 21.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.208 1.803 . . . . 0.0 114.381 -172.796 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -87.68 -15.62 36.65 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -171.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -67.69 165.35 17.37 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.914 1.285 . . . . 0.0 112.115 165.023 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.6 p30 -119.35 169.46 9.98 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.466 1.127 . . . . 0.0 112.043 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.2 -26.5 39.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.667 1.187 . . . . 0.0 112.819 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -63.71 -51.58 64.38 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.953 1.301 . . . . 0.0 111.275 -179.161 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -62.89 -39.03 93.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.528 0.731 . . . . 0.0 111.587 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.33 -46.03 90.52 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.294 0.637 . . . . 0.0 111.608 174.289 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.4 p -62.04 -25.81 67.89 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.984 -1.073 . . . . 0.0 113.685 177.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -84.27 -39.05 19.72 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.487 1.515 . . . . 0.0 112.021 -177.187 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -91.16 -38.68 12.58 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.259 1.024 . . . . 0.0 113.348 -179.762 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.01 -19.88 42.99 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.561 1.144 . . . . 0.0 113.072 177.976 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 61.76 69.33 0.65 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.876 1.67 . . . . 0.0 112.143 -177.49 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.5 pt -137.42 168.39 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 126.734 2.013 . . . . 0.0 111.467 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.7 m -60.81 139.21 58.01 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.413 1.485 . . . . 0.0 110.147 162.496 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -61.12 -35.29 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.28 -0.887 . . . . 0.0 111.511 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.79 -30.01 66.36 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.095 -1.003 . . . . 0.0 113.377 177.551 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.47 -40.05 94.96 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.82 167.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.07 -48.42 73.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.194 0.906 . . . . 0.0 110.962 177.254 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -56.1 -40.84 74.29 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.797 1.239 . . . . 0.0 112.476 179.474 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -88.4 -33.68 17.81 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.19 -38.31 90.69 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.237 1.015 . . . . 0.0 112.359 177.48 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.5 mt -48.92 -52.54 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.216 1.006 . . . . 0.0 110.651 175.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -80.85 -32.33 35.09 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -75.6 -26.73 58.11 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.882 1.219 . . . . 0.0 113.179 -179.024 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.5 t -88.54 -40.92 13.04 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.444 1.098 . . . . 0.0 112.626 174.656 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -149.64 75.65 1.27 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.296 1.038 . . . . 0.0 113.054 -177.198 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -62.3 -54.08 45.75 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.205 -0.935 . . . . 0.0 113.317 -179.367 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 25.2 ptm -161.74 12.31 0.08 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.704 1.602 . . . . 0.0 113.496 -176.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.16 30.88 7.96 Favored Glycine 0 N--CA 1.471 1.003 0 O-C-N 120.919 -1.113 . . . . 0.0 114.436 -164.905 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 26.0 mmm-85 47.95 49.52 16.92 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.634 1.574 . . . . 0.0 112.025 -175.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 53.21 18.58 1.26 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.128 1.771 . . . . 0.0 115.09 -176.498 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.8 m120 48.45 32.36 3.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.887 1.675 . . . . 0.0 113.436 -167.327 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.29 -5.38 19.17 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.254 1.422 . . . . 0.0 114.478 -179.464 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -75.45 13.82 0.7 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.512 1.925 . . . . 0.0 115.526 -168.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -91.47 11.85 22.65 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.685 1.994 . . . . 0.0 113.752 -163.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.6 m -150.94 -47.84 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.658 2.783 . . . . 0.0 108.604 -169.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -73.99 156.08 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.224 1.01 . . . . 0.0 109.454 179.371 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.47 -7.11 0.57 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 127.411 2.284 . . . . 0.0 116.438 -178.683 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 37.2 mtm -96.91 -50.59 4.58 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.946 1.248 . . . . 0.0 113.678 -174.705 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -91.41 -7.67 50.05 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -176.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -83.63 6.68 19.93 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.221 1.408 . . . . 0.0 114.247 -168.699 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -122.13 129.72 52.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.283 1.833 . . . . 0.0 111.46 179.032 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -152.29 156.9 40.57 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.951 1.3 . . . . 0.0 111.119 174.361 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.5 t -139.5 -39.28 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 125.206 1.402 . . . . 0.0 111.875 -176.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 33.2 m -127.13 22.0 6.69 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.15 1.38 . . . . 0.0 113.191 -173.507 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.9 t 57.86 58.87 3.42 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.878 1.671 . . . . 0.0 112.811 -174.528 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.53 164.47 25.79 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.029 1.332 . . . . 0.0 113.708 -179.543 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 83.7 p -110.49 170.41 8.1 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.566 1.547 . . . . 0.0 112.798 177.784 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.18 21.09 0.61 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.158 1.383 . . . . 0.0 114.186 178.231 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 50.93 71.55 1.5 Allowed Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 127.042 2.137 . . . . 0.0 113.105 -179.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.77 87.2 0.69 Allowed 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.531 3.488 . . . . 0.0 112.372 -174.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -136.77 33.71 2.67 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.128 1.771 . . . . 0.0 111.883 -179.63 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 93.2 mt -98.21 146.18 31.1 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.507 1.523 . . . . 0.0 111.866 -179.08 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo . . . . . 0 C--O 1.253 1.236 0 C-N-CA 124.05 3.167 . . . . 0.0 113.311 178.792 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.592 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 53.5 m -133.84 161.7 34.03 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.624 1.57 . . . . 0.0 112.066 -177.319 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -112.36 140.74 46.83 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.084 1.353 . . . . 0.0 111.51 177.258 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 24.3 ttt -137.04 63.31 1.57 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.278 1.431 . . . . 0.0 111.937 -167.716 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -147.46 92.47 2.1 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.701 1.2 . . . . 0.0 110.717 173.239 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 17.9 m -138.93 7.78 2.49 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -165.392 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.2 mtm -138.6 -7.66 1.47 Allowed 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 -168.114 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -132.56 12.96 4.51 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.242 1.417 . . . . 0.0 112.164 -178.073 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -145.03 12.09 1.39 Allowed 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -160.048 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.2 mp -130.69 64.26 1.56 Allowed 'General case' 0 N--CA 1.476 0.852 0 O-C-N 120.589 -1.32 . . . . 0.0 111.201 -174.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -133.31 11.66 4.17 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.976 1.31 . . . . 0.0 113.855 -171.187 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -131.53 19.2 4.75 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.476 1.51 . . . . 0.0 114.211 -169.128 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 56.6 mt -87.34 68.93 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.441 1.496 . . . . 0.0 110.111 -167.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 20.9 tt -152.46 72.58 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.956 1.303 . . . . 0.0 112.212 -173.642 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -128.57 32.18 4.87 Favored 'General case' 0 CA--C 1.552 1.055 0 O-C-N 120.728 -1.232 . . . . 0.0 113.363 -174.183 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -143.35 -63.55 0.4 Allowed 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.827 -1.17 . . . . 0.0 113.143 -179.389 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 10.4 pt -125.81 111.49 27.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.969 1.707 . . . . 0.0 109.729 -176.665 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -154.15 166.82 31.88 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.926 1.691 . . . . 0.0 112.102 -172.665 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -79.75 39.54 0.42 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.673 1.989 . . . . 0.0 113.613 -171.62 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -88.62 117.88 27.89 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.929 1.291 . . . . 0.0 111.086 175.874 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.87 -73.31 0.29 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.67 1.188 . . . . 0.0 111.658 168.115 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 59.2 mt -123.42 -8.23 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.894 1.278 . . . . 0.0 113.771 -173.732 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -68.04 -23.27 64.96 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.311 -0.868 . . . . 0.0 112.764 -173.896 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.4 m -82.65 -17.97 42.72 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.076 1.35 . . . . 0.0 114.354 -173.34 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -109.98 -14.07 14.31 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 179.274 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 74.2 t -84.37 -38.54 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.387 1.075 . . . . 0.0 111.178 177.02 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.2 t -101.76 77.49 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.752 1.221 . . . . 0.0 109.797 -177.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.1 mt -131.82 145.02 51.33 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.806 1.642 . . . . 0.0 111.544 178.471 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -129.13 37.7 4.01 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 126.028 1.731 . . . . 0.0 112.595 -178.534 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 t30 49.94 66.04 6.12 Favored Pre-proline 0 CA--C 1.557 1.239 0 C-N-CA 126.788 2.035 . . . . 0.0 113.674 -179.824 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -77.05 67.27 7.62 Favored 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 124.493 3.462 . . . . 0.0 112.497 -176.394 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -133.84 -58.84 0.86 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.273 1.829 . . . . 0.0 112.576 -178.319 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 44.4 t -137.63 97.75 10.14 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 125.145 1.378 . . . . 0.0 109.902 -175.614 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -76.99 170.39 19.88 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.297 2.664 . . . . 0.0 113.045 173.656 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.4 p -128.39 71.25 1.38 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.43 1.492 . . . . 0.0 112.343 -163.123 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -107.03 22.62 15.7 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -170.329 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.73 26.25 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 128.193 2.597 . . . . 0.0 115.452 -178.691 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.7 t -146.39 11.66 1.16 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.138 1.375 . . . . 0.0 114.161 -163.548 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.7 74.52 0.07 OUTLIER Glycine 0 CA--C 1.531 1.055 0 O-C-N 120.43 -1.419 . . . . 0.0 112.469 -177.272 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -121.08 21.46 11.27 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.011 1.324 . . . . 0.0 113.776 -165.214 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp 58.99 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.395 2.678 . . . . 0.0 113.894 -176.281 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -82.73 -71.37 0.5 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.996 0.918 . . . . 0.0 112.726 -175.536 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -163.57 -35.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.101 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -29.22 47.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.74 0.416 . . . . 0.0 111.095 170.906 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -77.62 -42.64 34.21 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.569 1.548 . . . . 0.0 112.045 -168.576 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -68.73 -26.14 65.11 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.228 -0.92 . . . . 0.0 113.035 173.752 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -68.9 -1.09 6.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.164 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 mt -113.86 -45.23 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.414 1.486 . . . . 0.0 110.209 172.078 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 36.4 t -73.55 -64.16 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 CA-C-N 119.459 1.027 . . . . 0.0 112.01 179.07 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.01 -27.42 65.66 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.786 -0.571 . . . . 0.0 112.377 -174.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.67 -42.36 78.89 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 165.699 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -36.45 81.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.905 0.882 . . . . 0.0 111.736 175.557 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.4 mm -62.84 -22.11 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 120.861 -1.149 . . . . 0.0 111.429 175.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 t -83.79 -11.16 57.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 171.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -96.93 -60.03 1.68 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.522 -1.361 . . . . 0.0 112.099 -175.835 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -113.46 -17.47 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 N-CA-C 114.922 1.452 . . . . 0.0 114.922 -164.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.47 -83.87 0.26 Allowed Glycine 0 N--CA 1.465 0.632 0 C-N-CA 125.349 1.452 . . . . 0.0 111.171 167.615 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -161.3 -46.7 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.58 1.152 . . . . 0.0 112.333 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -96.97 -20.31 18.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.189 1.796 . . . . 0.0 114.472 -174.765 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -84.65 -11.26 56.29 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -167.627 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.31 163.03 23.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.178 1.791 . . . . 0.0 114.417 176.4 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -87.75 -172.41 3.85 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.77 1.628 . . . . 0.0 109.991 174.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -120.82 -19.22 7.4 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.038 1.335 . . . . 0.0 112.964 167.379 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.9 m -72.26 -53.41 12.57 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.401 1.08 . . . . 0.0 112.286 -173.415 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.2 -25.03 65.02 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 120.75 -1.219 . . . . 0.0 113.673 179.764 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.28 -58.89 4.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.517 0.727 . . . . 0.0 111.101 166.566 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.5 p -61.1 -25.62 67.09 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -177.121 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -69.06 -41.16 77.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.567 1.547 . . . . 0.0 113.082 171.569 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -89.73 -37.95 14.19 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.272 1.429 . . . . 0.0 112.879 -174.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -20.33 57.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.103 1.361 . . . . 0.0 113.172 171.028 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.21 58.91 2.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.833 1.253 . . . . 0.0 111.398 -177.717 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.0 pt -123.25 174.47 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 127.069 2.147 . . . . 0.0 110.185 174.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 51.7 m -70.36 141.29 52.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.643 1.577 . . . . 0.0 109.515 166.783 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.3 t -58.58 -39.39 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 O-C-N 121.426 -0.796 . . . . 0.0 111.057 179.442 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -70.52 -28.5 64.99 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -66.34 -39.52 89.28 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.125 -0.941 . . . . 0.0 110.786 168.796 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.65 72.22 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.251 0.932 . . . . 0.0 110.544 176.208 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -54.87 -37.73 66.63 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.088 1.355 . . . . 0.0 113.044 -179.143 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -86.51 -41.23 14.52 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 118.792 0.724 . . . . 0.0 112.732 174.695 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -61.33 -34.78 75.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.067 -1.02 . . . . 0.0 113.066 -177.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.0 mt -46.66 -62.75 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.134 1.374 . . . . 0.0 110.027 171.38 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -76.32 -19.11 58.56 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -179.417 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -77.02 -30.33 55.77 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.832 0.742 . . . . 0.0 112.502 177.222 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -102.88 -46.35 4.71 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.146 1.378 . . . . 0.0 113.61 -177.737 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.7 91.66 3.59 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.956 1.302 . . . . 0.0 111.998 -178.416 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 15.3 ptt85 -134.37 24.68 3.8 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.692 1.597 . . . . 0.0 115.026 176.64 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.1 mtt -76.43 -38.75 55.05 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.823 0.849 . . . . 0.0 112.809 -176.131 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.31 98.53 0.7 Allowed Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.456 1.503 . . . . 0.0 110.988 -177.403 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 48.8 33.64 4.56 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 125.451 1.5 . . . . 0.0 112.83 -173.308 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 50.78 31.68 6.26 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 126.618 1.967 . . . . 0.0 113.174 -175.381 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.3 m120 53.9 26.39 6.19 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.252 1.821 . . . . 0.0 115.049 -174.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -8.61 40.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.495 1.118 . . . . 0.0 113.917 -178.514 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 p90 -70.37 7.31 1.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.931 2.092 . . . . 0.0 116.619 -168.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 -4.62 59.21 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.448 1.499 . . . . 0.0 114.796 -169.8 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.5 m -141.88 -46.53 0.36 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.02 1.728 . . . . 0.0 109.93 -167.147 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.6 169.8 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 123.637 0.775 . . . . 0.0 111.329 173.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 69.06 -14.29 0.31 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.051 2.14 . . . . 0.0 115.5 -174.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 13.43 2.2 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 178.339 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -146.54 38.14 1.02 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.226 1.01 . . . . 0.0 112.904 -173.334 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -145.02 153.51 41.56 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.792 1.237 . . . . 0.0 112.975 -168.05 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -94.21 171.3 8.92 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.514 1.526 . . . . 0.0 112.202 -178.597 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -71.59 141.35 50.03 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.902 -1.124 . . . . 0.0 112.784 176.609 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.1 t -131.21 -48.18 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 125.057 1.343 . . . . 0.0 111.33 176.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 23.4 m -119.25 15.63 13.11 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.052 1.341 . . . . 0.0 113.641 -176.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.2 t 53.99 82.69 0.08 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 126.849 2.06 . . . . 0.0 113.738 -176.576 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -140.72 106.71 5.18 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.651 1.18 . . . . 0.0 111.442 -179.657 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.9 m -142.31 116.63 9.56 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.23 1.412 . . . . 0.0 111.138 -178.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 53.61 28.48 7.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.527 1.531 . . . . 0.0 114.796 -178.285 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -118.98 147.84 43.39 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 126.676 1.99 . . . . 0.0 111.969 -172.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.27 103.57 1.64 Allowed 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.331 2.687 . . . . 0.0 110.731 175.978 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -141.64 30.29 1.7 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.426 1.09 . . . . 0.0 112.731 -176.447 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 96.5 mt -126.88 87.63 56.18 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.164 1.785 . . . . 0.0 110.346 -175.301 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 C--O 1.252 1.217 0 C-N-CA 123.876 3.051 . . . . 0.0 113.233 179.547 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.61 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 61.6 p -127.35 149.0 50.25 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.528 1.531 . . . . 0.0 112.129 178.006 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -150.7 126.45 10.31 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.758 1.223 . . . . 0.0 110.502 178.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 64.5 mtt -138.88 106.62 5.63 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.676 1.191 . . . . 0.0 110.273 -178.679 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -119.9 19.39 12.4 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.273 1.429 . . . . 0.0 114.473 -175.117 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 67.0 m -119.07 17.48 13.25 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.484 1.514 . . . . 0.0 113.822 -169.639 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -150.6 -13.0 0.24 Allowed 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 116.309 1.966 . . . . 0.0 116.309 -176.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -133.38 13.25 4.17 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.683 1.593 . . . . 0.0 112.611 -175.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -139.4 18.12 2.56 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.398 1.879 . . . . 0.0 112.234 -171.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 68.4 mt -118.22 173.54 6.74 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.772 1.629 . . . . 0.0 111.038 -174.025 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -131.68 12.8 4.9 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -177.788 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -97.61 4.25 50.23 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -176.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.409 HD13 ' H ' ' A' ' 7' ' ' ILE . 2.9 mp -76.31 -40.26 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.212 1.005 . . . . 0.0 112.463 -167.928 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 65.5 mt -134.35 142.07 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.808 1.643 . . . . 0.0 109.961 -174.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -120.66 157.64 29.14 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.118 1.767 . . . . 0.0 111.629 177.515 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -140.71 -74.15 0.34 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.542 1.137 . . . . 0.0 111.865 -172.453 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.4 tt -140.0 118.24 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 126.05 1.74 . . . . 0.0 109.461 -179.217 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -152.45 35.87 0.51 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.259 1.424 . . . . 0.0 112.588 -169.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 52.72 35.55 18.78 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 126.353 1.861 . . . . 0.0 114.392 177.153 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 48.8 76.13 0.13 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.908 2.083 . . . . 0.0 114.348 -175.591 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.1 -70.41 0.44 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -175.702 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 50.9 mt -131.54 -14.15 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 125.451 1.501 . . . . 0.0 113.304 -175.856 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -71.54 -20.12 62.08 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -166.024 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.2 m -100.46 -40.3 7.53 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.888 0.875 . . . . 0.0 112.774 -176.468 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -83.14 -12.12 57.28 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 -175.175 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -101.72 -30.78 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.777 1.231 . . . . 0.0 111.795 170.441 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.0 t -131.36 88.67 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.749 1.22 . . . . 0.0 110.431 -177.367 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.6 tp -117.21 136.93 52.7 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.448 1.099 . . . . 0.0 111.258 173.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -127.29 28.34 5.74 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.873 1.669 . . . . 0.0 112.548 -175.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.2 t30 45.82 60.84 13.42 Favored Pre-proline 0 CA--C 1.557 1.215 0 C-N-CA 127.076 2.15 . . . . 0.0 113.324 -173.285 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -79.92 67.72 8.53 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 124.14 3.227 . . . . 0.0 112.611 -171.088 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -117.71 -67.62 0.98 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.823 1.649 . . . . 0.0 112.196 -177.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.0 t -145.43 108.68 4.5 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.644 1.578 . . . . 0.0 109.498 -175.468 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -80.54 170.73 15.52 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.42 2.747 . . . . 0.0 113.313 175.115 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.4 p -132.79 77.8 1.76 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.863 1.665 . . . . 0.0 111.645 -163.561 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -119.59 19.27 12.64 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -171.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.6 ttpt -87.81 77.98 8.46 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.636 1.574 . . . . 0.0 111.234 -176.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.2 t -142.59 48.78 1.52 Allowed 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 123.059 1.409 . . . . 0.0 112.576 -171.073 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.74 66.42 1.41 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.68 1.134 . . . . 0.0 112.975 178.413 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -89.11 14.19 11.34 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.4 1.48 . . . . 0.0 114.078 -173.059 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp -129.12 136.8 50.69 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 126.374 1.87 . . . . 0.0 110.534 178.941 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.6 p -126.46 -69.64 0.76 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.667 1.587 . . . . 0.0 112.378 174.786 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.89 -34.31 0.05 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -167.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -76.83 -13.98 59.95 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.568 0.747 . . . . 0.0 111.278 172.347 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 mp0 -86.87 -43.65 12.29 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.097 0.862 . . . . 0.0 112.719 -177.304 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.32 -32.9 74.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.153 -0.967 . . . . 0.0 112.367 178.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -64.5 -2.79 2.52 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 115.548 1.685 . . . . 0.0 115.548 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.8 mt -112.12 -17.4 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.734 1.613 . . . . 0.0 112.276 174.443 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 17.9 t -127.68 -53.14 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.187 0.903 . . . . 0.0 113.373 -172.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.82 -37.89 88.54 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.778 1.172 . . . . 0.0 110.845 171.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.95 -28.3 69.43 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.992 0.917 . . . . 0.0 113.054 170.749 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -37.84 59.24 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.307 1.043 . . . . 0.0 111.59 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.5 -33.78 55.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.937 -1.102 . . . . 0.0 110.773 170.327 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -72.57 -10.31 59.64 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 169.67 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -107.53 -42.72 4.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.499 1.499 . . . . 0.0 112.987 -172.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.0 m -127.99 -13.19 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -173.082 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -83.35 0.3 Allowed Glycine 0 N--CA 1.469 0.89 0 C-N-CA 124.931 1.253 . . . . 0.0 112.223 169.092 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.8 tt -167.85 -44.5 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.123 1.769 . . . . 0.0 111.01 -177.504 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -107.44 -10.57 15.71 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.174 1.79 . . . . 0.0 114.913 -168.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -89.2 -20.34 24.31 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -176.39 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.15 162.82 23.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.638 1.175 . . . . 0.0 112.116 166.48 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -120.73 174.24 6.71 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.526 1.155 . . . . 0.0 112.007 174.805 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.1 -23.95 35.43 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.906 1.282 . . . . 0.0 112.995 179.355 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.7 m -63.36 -51.4 66.09 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.252 1.421 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -64.33 -39.07 93.16 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.41 -0.806 . . . . 0.0 112.183 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.33 -51.03 71.5 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 168.537 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.5 p -60.14 -24.86 65.03 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.686 -1.259 . . . . 0.0 113.831 -178.529 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -87.15 -47.93 8.48 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.177 1.791 . . . . 0.0 111.922 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -90.24 -29.53 18.13 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.368 1.067 . . . . 0.0 113.39 -174.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.2 tp -93.99 -14.57 25.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.759 1.624 . . . . 0.0 112.785 178.623 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.16 66.59 0.94 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.307 1.843 . . . . 0.0 112.644 175.569 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 pt -142.94 167.56 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 127.263 2.225 . . . . 0.0 111.078 -179.059 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 7.4 m -53.93 139.55 33.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.581 1.552 . . . . 0.0 110.813 164.487 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 t -58.31 -38.54 69.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 121.602 -0.686 . . . . 0.0 111.149 175.326 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -72.9 -28.67 62.62 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.132 -0.98 . . . . 0.0 113.356 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -66.57 -37.43 84.92 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.498 -0.763 . . . . 0.0 110.937 168.139 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.12 -47.49 73.96 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.843 0.747 . . . . 0.0 110.555 174.954 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -57.28 -38.85 74.57 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.24 1.016 . . . . 0.0 112.738 -179.544 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -89.6 -31.64 17.48 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -63.65 -38.04 89.61 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 120.585 -1.322 . . . . 0.0 112.138 176.492 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.9 mt -49.66 -56.67 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.143 0.977 . . . . 0.0 110.545 174.648 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -70.93 -35.76 72.37 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 179.106 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -66.88 -31.54 72.21 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.348 0.976 . . . . 0.0 112.965 178.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -76.9 -40.29 47.91 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.287 1.035 . . . . 0.0 112.697 175.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -147.13 87.24 1.66 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.903 1.281 . . . . 0.0 111.592 -178.897 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -59.4 -42.27 91.38 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.223 1.409 . . . . 0.0 112.871 178.531 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.6 mtt -125.04 -36.13 2.58 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.744 1.618 . . . . 0.0 112.755 178.587 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 133.14 73.25 0.09 OUTLIER Glycine 0 N--CA 1.474 1.181 0 C-N-CA 123.423 0.535 . . . . 0.0 112.445 177.922 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 58.34 15.76 3.64 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -177.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 89.5 m -73.05 -10.15 59.49 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.892 0.877 . . . . 0.0 112.523 177.288 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.89 25.14 15.11 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.922 2.089 . . . . 0.0 113.426 165.16 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -87.96 -10.05 51.68 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.414 1.485 . . . . 0.0 113.449 -173.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -76.05 15.47 0.55 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.679 2.392 . . . . 0.0 114.59 -176.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 32.4 pttt -83.34 -6.71 59.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.22 2.608 . . . . 0.0 114.191 -171.14 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 44.3 m -143.16 -54.54 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 126.586 1.955 . . . . 0.0 109.806 -172.486 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.5 pt -71.98 164.74 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.038 0.935 . . . . 0.0 111.91 177.81 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 -4.41 0.48 Allowed 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -178.617 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 44.3 mtm -97.83 -49.49 4.79 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.764 1.166 . . . . 0.0 113.627 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -107.26 -7.29 16.8 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -175.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -90.91 128.05 36.62 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.127 1.371 . . . . 0.0 111.568 -174.1 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -143.52 125.9 15.71 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.823 1.249 . . . . 0.0 110.817 174.224 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -145.74 147.93 32.44 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.145 1.778 . . . . 0.0 110.506 175.616 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 45.4 t -130.62 -45.01 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 124.189 0.996 . . . . 0.0 112.057 -179.33 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.0 p -119.83 7.61 11.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.341 1.456 . . . . 0.0 114.073 -176.166 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 t -137.12 24.24 3.01 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -168.733 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -102.61 133.74 47.11 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.642 1.177 . . . . 0.0 111.793 175.547 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.0 t -155.28 173.5 16.54 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.99 1.716 . . . . 0.0 109.697 176.358 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.73 -25.61 68.27 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.451 -0.78 . . . . 0.0 112.645 164.587 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.83 81.64 6.3 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.655 1.982 . . . . 0.0 112.961 175.527 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -79.83 50.11 3.41 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 124.576 3.517 . . . . 0.0 112.752 -176.76 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -117.88 65.42 0.75 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.467 1.907 . . . . 0.0 111.173 -169.064 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.5 tp -133.78 100.58 13.32 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.975 1.31 . . . . 0.0 110.677 -178.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo . . . . . 0 C--O 1.253 1.235 0 C-N-CA 123.789 2.992 . . . . 0.0 113.328 -179.407 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 63.1 m -127.57 153.05 46.85 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.384 1.474 . . . . 0.0 111.81 179.682 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -149.12 139.18 22.12 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.505 1.122 . . . . 0.0 111.651 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 66.3 mtt -136.4 95.31 3.15 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.088 1.355 . . . . 0.0 110.589 178.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -156.05 105.77 2.37 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.188 1.395 . . . . 0.0 110.235 175.035 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.5 t -116.41 -10.66 11.28 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 179.782 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 mmt -128.56 -7.94 5.15 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -169.381 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -113.68 6.44 16.88 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.068 1.747 . . . . 0.0 111.715 172.626 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.59 44.82 0.94 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.106 1.362 . . . . 0.0 111.94 -161.981 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 mp -132.24 111.03 11.04 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.589 1.556 . . . . 0.0 110.049 177.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -148.98 14.9 0.92 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.684 1.193 . . . . 0.0 113.157 -176.083 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -86.64 6.99 28.35 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.666 1.587 . . . . 0.0 114.388 -176.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -83.94 132.55 31.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 125.285 1.434 . . . . 0.0 111.458 -169.677 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.3 mp -89.73 -41.7 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.674 1.19 . . . . 0.0 111.412 179.425 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -138.92 134.7 33.56 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.505 1.522 . . . . 0.0 110.618 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -134.14 -62.59 0.75 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.68 0.792 . . . . 0.0 112.733 -178.123 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 39.1 pt -134.03 15.11 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.831 1.653 . . . . 0.0 113.387 -176.748 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -140.59 160.05 40.87 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.344 1.458 . . . . 0.0 112.482 -166.982 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -89.33 18.48 5.16 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.908 1.683 . . . . 0.0 113.838 176.669 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 58.87 122.91 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 127.78 2.432 . . . . 0.0 114.574 -166.72 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.74 -84.8 0.56 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.957 0.903 . . . . 0.0 112.142 175.435 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.9 mt -121.53 -12.93 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -168.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -74.74 -15.91 60.75 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -174.425 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 t -92.13 -53.74 4.12 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.6 1.16 . . . . 0.0 112.104 -174.673 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -66.9 -15.95 63.99 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -176.481 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.7 p -95.69 -8.55 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.848 1.659 . . . . 0.0 112.968 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.5 t -131.24 73.85 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.82 1.648 . . . . 0.0 109.738 178.657 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.4 mt -121.66 121.24 36.92 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.305 1.442 . . . . 0.0 111.598 -178.443 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -139.24 54.48 1.71 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.611 1.964 . . . . 0.0 111.544 178.151 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 t30 47.49 72.28 1.32 Allowed Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 126.999 2.12 . . . . 0.0 113.469 -177.048 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.74 74.97 4.65 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 124.109 3.206 . . . . 0.0 112.393 -174.346 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -121.04 -56.31 1.93 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.304 1.442 . . . . 0.0 113.152 179.058 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.1 t -137.29 65.51 50.04 Favored Pre-proline 0 N--CA 1.483 1.213 0 C-N-CA 124.283 1.033 . . . . 0.0 111.703 -177.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.03 156.59 47.38 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.429 2.086 . . . . 0.0 112.796 174.151 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.6 p -78.19 59.82 2.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.685 2.394 . . . . 0.0 113.522 -176.059 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -79.65 27.83 0.28 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.344 1.857 . . . . 0.0 115.834 -171.867 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.405 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -85.65 57.81 4.68 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 127.664 2.386 . . . . 0.0 112.481 -171.845 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.5 t -148.68 16.22 0.99 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -163.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -163.77 -69.72 0.02 OUTLIER Glycine 0 N--CA 1.474 1.183 0 O-C-N 120.346 -1.471 . . . . 0.0 113.498 178.948 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 62.18 18.48 10.13 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 115.864 1.802 . . . . 0.0 115.864 175.251 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp -136.11 129.78 32.35 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.036 1.334 . . . . 0.0 110.589 168.171 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.6 m -116.7 -70.21 0.81 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.308 1.843 . . . . 0.0 112.68 -175.182 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -161.82 -41.21 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -171.682 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.1 -27.6 61.8 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.627 . . . . 0.0 110.866 174.198 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -72.91 -33.93 66.29 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.872 1.269 . . . . 0.0 110.803 -176.087 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -70.21 -34.5 72.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.879 0.871 . . . . 0.0 112.296 170.509 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -65.46 -3.73 4.77 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 171.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 mt -107.85 -53.89 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.772 1.629 . . . . 0.0 110.124 167.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.21 -62.85 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 124.194 0.998 . . . . 0.0 112.148 -174.431 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.93 66.88 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.593 0.757 . . . . 0.0 111.903 -177.113 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.12 -44.8 83.65 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.792 0.437 . . . . 0.0 111.945 164.738 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.03 -38.11 89.87 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.343 1.057 . . . . 0.0 112.47 174.806 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -62.6 -19.4 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.941 0.897 . . . . 0.0 111.632 176.182 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -88.18 -13.07 42.08 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.98 1.312 . . . . 0.0 114.26 172.305 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -96.82 -55.57 2.84 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.544 -1.348 . . . . 0.0 112.207 -175.14 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.9 m -118.64 -18.11 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -167.551 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.23 -85.79 0.32 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 125.775 1.655 . . . . 0.0 111.049 169.664 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.5 tp -167.04 -36.6 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.947 1.299 . . . . 0.0 112.919 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -104.53 -9.43 18.34 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.01 1.324 . . . . 0.0 114.035 -173.996 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -97.23 -14.74 21.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.568 1.147 . . . . 0.0 113.412 -175.82 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -70.59 164.33 25.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.071 1.348 . . . . 0.0 111.942 170.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -121.9 167.72 12.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.294 1.045 . . . . 0.0 112.114 174.182 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.08 -25.52 43.07 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.397 1.079 . . . . 0.0 112.668 -178.421 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.7 m -64.41 -45.49 87.35 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.67 1.588 . . . . 0.0 112.208 -179.113 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -65.52 -36.93 85.27 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.611 -1.305 . . . . 0.0 112.231 176.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.27 -49.24 72.62 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.4 0.68 . . . . 0.0 111.818 172.35 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.3 p -64.98 -25.69 67.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.046 0.938 . . . . 0.0 113.312 -179.083 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -76.11 -35.61 59.22 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.159 1.384 . . . . 0.0 112.712 177.11 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.6 mmm-85 -100.13 -32.77 10.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.981 1.312 . . . . 0.0 113.452 -172.397 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.3 mt -86.8 -19.31 29.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.103 1.361 . . . . 0.0 112.829 173.194 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.63 57.73 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.277 1.431 . . . . 0.0 112.072 -176.09 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.8 pt -120.28 167.4 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 127.747 2.419 . . . . 0.0 109.928 175.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.2 t -70.91 151.42 44.73 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.392 -0.817 . . . . 0.0 110.747 165.679 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.79 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.006 0.922 . . . . 0.0 111.262 -177.41 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -67.46 -32.63 73.62 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 179.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.77 -35.29 76.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.206 171.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.25 -47.39 67.9 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.809 0.731 . . . . 0.0 110.636 175.726 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -57.04 -41.96 79.62 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.231 1.412 . . . . 0.0 112.831 179.249 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 t -83.86 -34.08 24.68 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.173 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -65.71 -36.19 82.9 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.972 -1.08 . . . . 0.0 112.32 176.899 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.7 mt -51.13 -60.44 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.098 0.959 . . . . 0.0 109.841 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -54.14 -26.9 30.14 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 127.472 2.309 . . . . 0.0 115.802 174.422 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -78.21 -13.33 59.9 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 176.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -99.66 -42.42 6.88 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.648 1.179 . . . . 0.0 111.652 160.307 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -79.78 79.53 6.27 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 127.221 2.209 . . . . 0.0 112.426 178.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.7 tpp85 -122.21 1.95 9.74 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -179.506 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 95.7 mmm -121.47 52.78 1.21 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.826 1.25 . . . . 0.0 111.542 -164.446 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.74 -125.1 0.84 Allowed Glycine 0 CA--C 1.526 0.752 0 C-N-CA 125.484 1.516 . . . . 0.0 109.962 -179.98 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 92.7 mtm-85 -72.91 2.92 5.93 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 -176.156 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m -72.5 11.41 0.62 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.504 1.522 . . . . 0.0 113.775 173.437 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 65.54 37.13 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 128.038 2.535 . . . . 0.0 111.868 166.002 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -78.29 -19.43 53.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.398 1.879 . . . . 0.0 114.942 -177.694 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -110.95 20.34 17.6 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.787 1.235 . . . . 0.0 112.78 -150.715 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -86.66 9.05 19.88 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 128.211 2.605 . . . . 0.0 114.721 -173.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.9 m -146.38 -49.32 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.439 1.895 . . . . 0.0 109.699 -169.327 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -80.86 155.38 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.411 1.485 . . . . 0.0 109.417 179.483 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? 64.04 14.19 8.3 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 126.011 1.724 . . . . 0.0 115.316 -178.6 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 20.9 mtm -115.48 -21.34 9.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 -178.048 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -129.27 -6.1 4.84 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -174.98 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -94.49 18.51 11.18 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.218 1.407 . . . . 0.0 113.018 -174.142 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -88.03 16.09 6.5 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.86 1.664 . . . . 0.0 114.852 -168.306 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -130.12 142.95 50.55 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.061 1.744 . . . . 0.0 111.388 176.446 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.0 t -127.91 -47.87 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 124.62 1.168 . . . . 0.0 111.737 -176.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.8 m -119.44 14.72 12.87 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.84 1.256 . . . . 0.0 113.576 -176.791 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 t -138.6 18.62 2.71 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.375 1.47 . . . . 0.0 114.02 -175.33 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.8 156.65 19.3 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.837 1.255 . . . . 0.0 112.568 177.322 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.4 m -134.7 160.46 38.08 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.558 1.543 . . . . 0.0 111.368 177.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -78.18 24.76 0.24 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.422 1.489 . . . . 0.0 114.502 -177.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 58.75 165.31 0.08 OUTLIER Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 128.651 2.781 . . . . 0.0 114.719 -174.148 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.0 67.89 5.85 Favored 'Trans proline' 0 CA--C 1.545 1.072 0 C-N-CA 123.768 2.979 . . . . 0.0 112.24 179.732 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -132.45 63.77 1.62 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.774 2.03 . . . . 0.0 110.39 -175.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.3 tp -118.39 80.32 16.14 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.588 1.555 . . . . 0.0 110.767 -177.9 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.253 1.233 0 C-N-CA 123.959 3.106 . . . . 0.0 113.296 -179.765 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 112.031 -0.427 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 13.5 t -147.77 154.2 40.21 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.374 1.47 . . . . 0.0 111.243 175.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -143.82 117.42 9.19 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.69 1.196 . . . . 0.0 110.621 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 96.3 mtp -138.2 74.9 1.5 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.062 1.345 . . . . 0.0 110.777 -179.522 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 60.6 -35.16 0.08 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 128.978 2.911 . . . . 0.0 117.322 -174.716 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 59.5 p 57.31 -46.11 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.916 1 C-N-CA 132.318 4.247 . . . . 0.0 117.002 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -104.65 -2.41 25.07 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.79 1.636 . . . . 0.0 115.018 -172.0 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -111.97 6.81 19.63 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.397 1.479 . . . . 0.0 113.743 -179.127 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -138.43 23.11 2.73 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 115.297 1.591 . . . . 0.0 115.297 -168.273 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 85.8 mt -124.14 72.36 1.17 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.666 1.586 . . . . 0.0 111.934 -176.188 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -133.05 -5.79 3.08 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 114.998 1.481 . . . . 0.0 114.998 -174.38 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -101.63 89.27 3.65 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.72 1.208 . . . . 0.0 111.211 -179.002 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.5 mp -130.7 96.44 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.179 1.392 . . . . 0.0 108.909 178.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.1 mt -136.77 141.16 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 125.499 1.519 . . . . 0.0 109.892 -175.62 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -133.62 59.57 1.73 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.752 1.621 . . . . 0.0 110.831 179.87 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -137.09 -73.36 0.43 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.942 1.297 . . . . 0.0 111.443 -178.518 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.0 tt -144.06 118.09 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 126.112 1.765 . . . . 0.0 108.982 176.834 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -161.01 173.29 15.45 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.794 2.037 . . . . 0.0 109.662 -172.721 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -52.13 -29.59 22.57 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.34 1.456 . . . . 0.0 114.287 -177.004 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -104.14 20.05 19.0 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -177.492 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.9 -69.08 0.12 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.437 1.495 . . . . 0.0 114.216 176.993 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 68.7 mt -130.04 -8.45 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.753 1.221 . . . . 0.0 113.258 -171.475 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -71.58 -16.95 62.32 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -171.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -83.04 -45.94 13.43 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.15 0.98 . . . . 0.0 113.121 179.781 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -80.97 -17.01 51.9 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -171.351 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 74.5 t -77.01 -32.06 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.444 1.098 . . . . 0.0 111.859 179.603 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.7 t -104.78 62.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.082 1.353 . . . . 0.0 110.066 -176.805 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.7 tp -146.75 145.05 29.82 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.201 1.4 . . . . 0.0 111.449 -176.427 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.45 38.32 4.12 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.512 1.525 . . . . 0.0 113.369 -178.077 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.6 t30 47.12 64.19 8.9 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 126.763 2.025 . . . . 0.0 113.741 178.939 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -80.14 67.22 8.69 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 124.208 3.272 . . . . 0.0 113.917 -167.792 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -139.85 -57.66 0.56 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.027 1.731 . . . . 0.0 112.223 173.207 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.3 p -153.66 118.35 2.76 Favored Pre-proline 0 CA--C 1.543 0.696 0 C-N-CA 125.329 1.451 . . . . 0.0 110.864 -177.771 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -89.16 172.39 4.29 Favored 'Trans proline' 0 CA--C 1.536 0.588 0 C-N-CA 123.901 3.068 . . . . 0.0 113.067 173.491 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.8 p -136.84 88.92 2.4 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.98 1.712 . . . . 0.0 111.076 -164.151 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -120.82 25.7 9.53 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.946 1.699 . . . . 0.0 114.296 -176.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.447 ' HA ' ' HE3' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -81.09 51.63 1.62 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.851 1.66 . . . . 0.0 112.539 -174.418 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.7 t -139.07 8.52 2.5 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.667 1.587 . . . . 0.0 113.902 -165.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.02 -32.58 73.29 Favored Glycine 0 CA--C 1.537 1.434 0 O-C-N 120.683 -1.261 . . . . 0.0 115.285 -171.847 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.26 17.57 3.42 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.844 1.258 . . . . 0.0 113.303 -176.876 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp -135.87 132.64 36.83 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.556 1.543 . . . . 0.0 110.747 177.097 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 62.6 m -115.88 -68.98 0.88 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.162 1.785 . . . . 0.0 112.27 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -163.82 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 123.452 0.701 . . . . 0.0 111.443 -171.004 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -68.56 -28.83 67.31 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.547 1.139 . . . . 0.0 110.264 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -72.81 -34.89 67.16 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.475 1.11 . . . . 0.0 112.062 178.667 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -70.4 -34.98 73.16 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.848 -1.158 . . . . 0.0 112.491 173.085 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -60.89 -6.32 1.76 Allowed 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 168.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.3 mt -108.13 -56.79 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.84 1.656 . . . . 0.0 110.342 169.419 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.1 t -69.18 -61.79 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 123.856 0.862 . . . . 0.0 111.373 -173.599 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.38 70.56 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.358 0.663 . . . . 0.0 111.829 -177.097 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.06 -44.61 87.56 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 122.889 0.475 . . . . 0.0 112.197 167.681 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -36.75 80.92 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.992 0.917 . . . . 0.0 112.257 175.329 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.1 mm -60.56 -28.32 42.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.772 -1.205 . . . . 0.0 110.655 175.664 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -77.14 -14.75 59.74 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 173.074 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -93.74 -54.28 3.69 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.398 -1.439 . . . . 0.0 112.115 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.3 m -118.63 -13.17 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -164.709 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.7 -77.31 0.4 Allowed Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.365 1.46 . . . . 0.0 112.106 166.438 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.9 tp -163.66 -43.5 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.321 1.449 . . . . 0.0 111.854 170.758 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -108.96 -5.6 16.03 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -167.606 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -89.7 -17.71 27.82 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.037 0.935 . . . . 0.0 112.993 -176.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.36 164.46 9.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.802 1.241 . . . . 0.0 112.528 165.863 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -110.36 167.01 10.52 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 122.292 1.044 . . . . 0.0 111.466 171.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.04 -24.25 37.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.145 0.978 . . . . 0.0 112.412 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.39 -45.25 93.96 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.192 1.797 . . . . 0.0 112.519 -179.49 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -65.26 -41.82 93.88 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.639 -1.288 . . . . 0.0 111.989 176.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.52 -46.06 90.13 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.657 -0.652 . . . . 0.0 111.912 174.235 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.7 p -65.37 -23.47 66.98 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.182 -0.949 . . . . 0.0 113.402 179.366 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.03 1.332 . . . . 0.0 112.389 176.253 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -102.74 -40.22 6.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.363 1.465 . . . . 0.0 113.072 -169.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.4 mp -81.03 -17.77 49.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.606 1.162 . . . . 0.0 113.207 170.304 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.92 58.24 2.83 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-O 122.693 1.235 . . . . 0.0 111.49 -175.282 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.1 pt -122.79 164.56 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 128.011 2.524 . . . . 0.0 109.532 177.024 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 t -70.64 153.49 42.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 121.243 -0.91 . . . . 0.0 110.766 167.568 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -58.3 -37.69 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.869 0.868 . . . . 0.0 111.167 -177.366 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.62 -29.99 68.62 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 179.396 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -67.3 -38.36 84.85 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.096 170.338 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.66 -48.12 67.56 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.632 0.651 . . . . 0.0 110.329 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -56.47 -32.41 64.94 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.95 1.7 . . . . 0.0 113.987 178.751 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -90.25 -42.05 11.22 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.968 0.804 . . . . 0.0 112.822 173.454 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.6 -35.77 72.96 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.899 -1.126 . . . . 0.0 113.333 -178.393 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.6 mt -50.37 -42.47 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 0.0 112.25 174.231 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -94.59 -25.76 16.66 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 176.396 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -68.87 -32.67 72.5 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.819 0.736 . . . . 0.0 112.952 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.0 t -87.69 -35.02 18.2 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.463 1.105 . . . . 0.0 113.749 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -108.76 -35.17 6.47 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -170.711 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 45.61 53.67 8.33 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 127.97 2.508 . . . . 0.0 113.326 -178.637 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 60.8 mtt 62.33 -39.57 0.15 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 128.902 2.881 . . . . 0.0 115.818 -171.726 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 178.05 37.08 0.06 OUTLIER Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.106 1.812 . . . . 0.0 112.571 176.386 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 60.2 mtt-85 48.39 70.27 0.47 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.92 2.088 . . . . 0.0 114.604 -171.469 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 41.1 p 54.41 41.97 31.67 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 123.247 1.499 . . . . 0.0 113.332 163.792 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -84.58 -8.0 59.06 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.457 2.303 . . . . 0.0 112.002 -173.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.4 -17.59 59.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 128.389 2.676 . . . . 0.0 113.163 176.666 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -71.52 15.69 0.13 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.015 2.126 . . . . 0.0 115.81 -174.709 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 31.6 mtmt -66.82 100.12 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.318 -1.489 . . . . 0.0 109.573 -176.085 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 75.79 2.58 3.72 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.385 2.674 . . . . 0.0 114.827 -176.623 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.2 mt -117.66 145.72 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.898 1.279 . . . . 0.0 109.993 -175.464 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 60.52 14.27 4.75 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.643 1.577 . . . . 0.0 114.344 -169.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.7 ptm -138.01 9.69 2.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.984 1.713 . . . . 0.0 114.02 -178.696 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -145.69 -36.05 0.29 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.03 1.492 . . . . 0.0 115.03 -163.099 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -76.33 146.51 38.77 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.355 -0.84 . . . . 0.0 112.9 -175.266 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -98.15 160.98 13.95 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.302 1.441 . . . . 0.0 112.535 177.124 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -71.42 137.3 48.2 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.722 0.809 . . . . 0.0 112.042 172.615 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.2 t -125.07 -38.25 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 125.001 1.32 . . . . 0.0 111.813 178.54 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.7 t -130.3 34.13 4.24 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.376 1.47 . . . . 0.0 112.273 179.818 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 81.1 p 47.85 36.08 5.55 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 127.278 2.231 . . . . 0.0 116.126 174.021 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.47 100.46 2.22 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.489 1.116 . . . . 0.0 112.091 -177.062 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.1 t -154.14 168.62 25.89 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.83 1.652 . . . . 0.0 111.394 -179.532 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.5 38.42 0.49 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.297 1.839 . . . . 0.0 113.395 -175.853 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 47.95 64.86 7.86 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 127.135 2.174 . . . . 0.0 113.382 -179.513 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -77.96 47.85 2.47 Favored 'Trans proline' 0 CA--C 1.545 1.048 1 C-N-CA 125.347 4.031 . . . . 0.0 113.179 -175.232 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -82.56 64.02 7.0 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.458 1.903 . . . . 0.0 111.81 -175.001 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 6.0 mp -116.85 74.41 6.73 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 125.723 1.609 . . . . 0.0 110.754 178.145 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.255 1.325 0 C-N-CA 123.942 3.095 . . . . 0.0 113.254 178.765 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 111.551 -0.62 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 60.5 p -139.71 163.64 32.06 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.839 1.656 . . . . 0.0 112.099 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -139.51 129.84 25.44 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.45 1.1 . . . . 0.0 111.531 178.254 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 95.0 mmm -129.17 106.12 8.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.737 1.615 . . . . 0.0 109.906 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.68 -64.61 0.43 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.559 1.144 . . . . 0.0 112.743 178.457 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.8 m 55.77 12.45 0.85 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.77 2.137 . . . . 0.0 116.77 177.024 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm -139.98 -15.69 1.0 Allowed 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -175.081 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -107.62 2.7 24.12 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.781 1.632 . . . . 0.0 112.422 173.386 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.72 55.71 0.96 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.501 1.52 . . . . 0.0 111.253 -166.024 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.31 165.74 25.06 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.335 1.454 . . . . 0.0 113.182 173.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.0 t0 55.8 42.18 29.37 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.168 1.787 . . . . 0.0 114.213 175.683 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -119.95 15.76 12.52 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.063 1.745 . . . . 0.0 114.27 -171.347 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.8 mp -81.26 67.46 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 125.141 1.376 . . . . 0.0 111.326 -172.456 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.5 tp -140.43 -10.55 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 125.14 1.376 . . . . 0.0 113.883 -177.534 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -98.01 48.12 1.01 Allowed 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.65 -1.281 . . . . 0.0 113.828 -165.763 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -137.71 -46.57 0.54 Allowed 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 179.41 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.7 pt -132.72 113.08 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.868 1.267 . . . . 0.0 110.751 -178.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.62 -176.97 6.19 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 128.065 2.546 . . . . 0.0 109.342 -176.761 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.6 mttp -67.48 94.3 0.4 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.077 0.951 . . . . 0.0 112.43 178.813 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.91 151.09 48.67 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.586 1.954 . . . . 0.0 110.394 165.448 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.87 26.96 2.03 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.524 1.53 . . . . 0.0 112.835 -173.708 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt 52.54 53.91 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-O 124.413 2.054 . . . . 0.0 110.425 -168.999 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.8 p-10 -121.9 -3.84 9.14 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.637 2.775 . . . . 0.0 112.671 -169.311 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.1 m -119.38 -39.75 2.86 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.739 1.215 . . . . 0.0 113.515 -178.181 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.8 p-10 -77.67 -22.15 51.02 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.231 1.412 . . . . 0.0 114.379 179.81 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 74.3 t -88.09 -32.56 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.565 1.546 . . . . 0.0 111.256 174.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.4 t -90.94 61.2 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.083 1.353 . . . . 0.0 110.222 -178.469 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.1 mt -121.27 146.45 46.81 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.194 1.797 . . . . 0.0 111.743 176.052 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -123.97 48.02 1.96 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.538 1.935 . . . . 0.0 111.726 -175.579 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 t30 48.4 73.85 0.92 Allowed Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 126.702 2.001 . . . . 0.0 113.292 178.917 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -72.66 84.17 1.26 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 123.928 3.085 . . . . 0.0 112.771 -171.341 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.6 mmt180 50.15 32.67 6.2 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 126.9 2.08 . . . . 0.0 114.855 176.402 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 87.7 t 50.15 102.85 0.03 OUTLIER Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 129.027 2.931 . . . . 0.0 112.732 -170.058 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.13 169.32 20.9 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.411 2.074 . . . . 0.0 112.349 176.72 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.1 p -76.0 33.69 0.12 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 127.309 2.243 . . . . 0.0 116.294 -164.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -122.97 65.46 0.97 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.369 1.467 . . . . 0.0 112.177 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.85 33.36 5.6 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 126.254 1.821 . . . . 0.0 111.879 179.076 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.6 t -145.22 13.28 1.41 Allowed 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.174 1.39 . . . . 0.0 113.669 -167.429 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.6 -38.47 90.3 Favored Glycine 0 CA--C 1.538 1.49 0 O-C-N 120.488 -1.383 . . . . 0.0 115.164 -169.362 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -148.58 3.33 0.65 Allowed 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -175.85 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp -105.56 112.61 25.76 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.239 1.816 . . . . 0.0 110.167 179.305 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -93.08 -78.41 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 125.489 1.516 . . . . 0.0 111.188 170.231 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -156.56 -46.13 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 122.971 0.508 . . . . 0.0 111.156 -172.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -65.83 -29.72 70.23 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.438 0.695 . . . . 0.0 111.683 175.542 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -73.63 -45.9 50.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.954 0.901 . . . . 0.0 111.866 -169.273 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -67.12 -28.14 67.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.221 1.009 . . . . 0.0 112.63 169.926 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -69.74 -1.74 10.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.803 1.241 . . . . 0.0 114.087 170.045 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -106.54 -53.76 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.149 1.38 . . . . 0.0 109.932 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.5 t -72.39 -59.15 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.092 0.86 . . . . 0.0 112.066 -174.694 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.87 64.48 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.495 0.589 . . . . 0.0 112.294 -177.41 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.18 -44.56 94.96 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.661 -0.65 . . . . 0.0 112.392 164.633 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.93 -34.31 77.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.053 0.842 . . . . 0.0 111.945 175.582 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -61.52 -22.66 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 O-C-N 120.559 -1.338 . . . . 0.0 112.023 174.154 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 t -83.63 -12.79 55.53 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.557 1.143 . . . . 0.0 114.065 171.952 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -93.41 -56.37 2.96 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.635 -1.291 . . . . 0.0 112.284 -175.607 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.3 m -122.94 -17.23 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 -165.611 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 130.45 -89.08 0.3 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 125.758 1.647 . . . . 0.0 110.413 172.711 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 54.3 tp -163.72 -36.33 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.101 1.36 . . . . 0.0 113.066 177.921 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -107.68 -2.66 19.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -173.287 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -94.91 -17.84 21.66 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.241 1.016 . . . . 0.0 112.955 178.771 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -73.43 164.41 26.7 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.336 1.454 . . . . 0.0 111.924 169.634 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.9 p30 -115.39 172.61 6.99 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.194 0.997 . . . . 0.0 111.653 170.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.79 -21.36 29.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.427 1.091 . . . . 0.0 112.611 178.571 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.0 m -63.25 -50.19 71.16 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.892 1.677 . . . . 0.0 111.643 -178.346 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -66.37 -45.53 79.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.829 -1.169 . . . . 0.0 112.276 -179.296 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -52.29 -54.31 32.96 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.504 1.122 . . . . 0.0 112.241 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.4 p -66.88 -27.99 67.96 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -177.599 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -70.8 -46.76 62.25 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.086 1.355 . . . . 0.0 112.637 173.324 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 66.1 mtt85 -78.46 -40.61 35.12 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.21 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -85.45 -19.01 31.92 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.395 1.478 . . . . 0.0 111.747 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.23 66.52 0.71 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.0 1.72 . . . . 0.0 111.92 179.069 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -132.37 172.75 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 127.004 2.121 . . . . 0.0 110.956 178.907 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 55.0 m -66.05 137.72 57.28 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.226 1.41 . . . . 0.0 109.05 165.625 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.7 t -57.41 -38.97 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 O-C-N 121.716 -0.615 . . . . 0.0 110.984 -179.131 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.87 -26.53 64.24 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.815 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -66.78 -39.49 87.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.566 -0.73 . . . . 0.0 111.268 169.526 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.53 -45.72 74.91 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.901 0.773 . . . . 0.0 110.299 175.031 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -54.79 -42.24 71.52 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.765 1.226 . . . . 0.0 112.608 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -83.4 -38.06 22.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 176.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.62 -33.75 75.63 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.067 -1.021 . . . . 0.0 113.277 -178.503 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -49.13 -47.0 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.988 1.315 . . . . 0.0 111.418 172.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -87.32 -26.88 23.17 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 175.694 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -66.98 -33.16 74.97 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.192 0.906 . . . . 0.0 112.632 -179.29 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.7 t -93.12 -39.52 11.0 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -178.398 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -100.19 -30.14 12.08 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -173.866 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 17.5 tpt85 46.36 53.59 9.45 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 128.151 2.58 . . . . 0.0 114.128 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 25.9 mmt 64.53 -28.39 0.1 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 128.122 2.569 . . . . 0.0 116.224 -176.359 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 158.06 -45.68 0.47 Allowed Glycine 0 N--CA 1.471 0.996 0 C-N-CA 124.711 1.148 . . . . 0.0 111.031 164.578 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 94.0 mtt-85 -124.57 -84.65 0.64 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.063 1.745 . . . . 0.0 110.319 163.647 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 72.3 p -145.51 20.6 1.52 Allowed 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -164.441 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 57.3 40.56 27.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.739 1.615 . . . . 0.0 111.616 -171.676 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -82.05 -19.07 41.04 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.536 1.535 . . . . 0.0 114.865 -174.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -116.06 10.61 15.09 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -141.824 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -85.12 -6.53 59.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.354 1.862 . . . . 0.0 115.02 -167.53 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.1 m -144.45 -46.39 0.25 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.709 1.603 . . . . 0.0 110.993 -164.094 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.2 pt -75.93 174.37 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.044 1.338 . . . . 0.0 111.889 175.128 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 65.21 -15.69 0.1 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 127.18 2.192 . . . . 0.0 116.16 -175.039 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.0 ptm -123.85 1.13 8.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.708 1.603 . . . . 0.0 114.241 -176.757 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -134.2 -9.59 2.6 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -166.13 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -104.94 94.25 5.15 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.849 1.26 . . . . 0.0 110.813 -173.76 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -150.22 159.17 44.63 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.231 1.412 . . . . 0.0 111.53 179.667 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -76.29 140.56 41.58 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.265 1.026 . . . . 0.0 112.681 178.213 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.7 t -131.25 -45.8 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.242 1.417 . . . . 0.0 111.069 176.157 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.7 m -122.79 30.95 6.23 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.695 1.598 . . . . 0.0 112.558 -179.196 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.9 m 47.17 56.47 6.82 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.918 2.087 . . . . 0.0 114.423 175.86 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.06 101.43 0.87 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.585 1.154 . . . . 0.0 111.896 -177.363 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.1 t -157.69 169.8 23.81 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.98 1.712 . . . . 0.0 111.129 -176.66 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -79.08 32.57 0.22 Allowed 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.154 1.781 . . . . 0.0 113.937 179.338 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 59.93 156.29 0.1 Allowed Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 129.533 3.133 . . . . 0.0 115.876 -175.031 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -76.89 83.91 2.02 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.704 2.936 . . . . 0.0 111.761 -176.234 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -126.88 32.97 5.02 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.668 1.587 . . . . 0.0 112.79 -175.391 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.8 tt -133.22 70.26 77.71 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 125.326 1.45 . . . . 0.0 110.576 176.452 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--O 1.254 1.287 0 C-N-CA 123.987 3.125 . . . . 0.0 113.255 179.319 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 112.179 -0.368 . . . . 0.0 112.179 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 88.6 p -144.59 163.35 34.16 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.555 1.542 . . . . 0.0 112.273 179.687 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.5 t-160 -133.02 33.5 3.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.933 1.293 . . . . 0.0 112.618 -174.275 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 90.7 mtp -84.59 66.51 9.57 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.098 1.359 . . . . 0.0 111.315 -176.932 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.35 90.4 2.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.895 1.678 . . . . 0.0 110.833 -176.45 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.7 t -137.97 17.07 2.83 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.076 1.35 . . . . 0.0 114.199 -171.274 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt -129.25 -26.87 2.52 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 115.127 1.529 . . . . 0.0 115.127 -175.969 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -109.63 -26.22 10.01 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.881 1.672 . . . . 0.0 112.414 176.094 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.45 HE22 ' CD1' ' A' ' 4' ' ' LEU . 12.8 tt0 -90.1 -43.23 10.62 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.146 1.378 . . . . 0.0 111.85 178.26 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.45 ' CD1' HE22 ' A' ' 3' ' ' GLN . 10.9 mp -99.36 133.48 43.6 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.972 1.309 . . . . 0.0 109.774 175.701 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -155.0 -52.73 0.09 Allowed 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 174.6 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -109.17 22.92 15.24 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.006 1.323 . . . . 0.0 113.416 -167.576 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.4 mm -84.86 60.22 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.387 1.475 . . . . 0.0 110.871 -166.337 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 25.3 mt -136.21 -42.92 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 126.302 1.841 . . . . 0.0 110.896 -175.954 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -135.57 166.82 22.34 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.569 1.548 . . . . 0.0 111.985 -177.76 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -131.66 163.04 29.0 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.585 1.554 . . . . 0.0 111.49 -176.746 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.6 pt -115.91 113.21 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 126.492 1.917 . . . . 0.0 111.41 -171.601 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -147.64 31.89 0.88 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.832 1.653 . . . . 0.0 113.682 -176.15 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 60.68 6.44 1.14 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 127.209 2.204 . . . . 0.0 116.523 -177.689 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -148.88 148.05 29.41 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.021 1.728 . . . . 0.0 110.125 172.526 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.92 -78.64 0.14 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.843 1.257 . . . . 0.0 111.482 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.3 mp -125.9 -16.54 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.005 1.322 . . . . 0.0 114.007 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -69.12 -17.68 63.87 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -165.682 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 m -91.29 -46.4 8.07 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.36 1.064 . . . . 0.0 112.477 175.656 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -79.23 -15.17 58.43 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -175.018 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.8 p -76.03 -15.86 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 123.835 0.854 . . . . 0.0 112.773 175.311 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.6 t -115.48 68.23 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 125.792 1.637 . . . . 0.0 110.276 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.77 22.66 6.81 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.34 1.456 . . . . 0.0 113.649 -173.652 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -100.14 45.84 0.97 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.631 2.772 . . . . 0.0 110.986 -174.153 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.6 t30 49.2 61.55 13.77 Favored Pre-proline 0 CA--C 1.557 1.235 0 C-N-CA 127.434 2.294 . . . . 0.0 113.797 -176.381 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -81.91 40.73 1.01 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 124.803 3.668 . . . . 0.0 114.41 -167.547 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.6 ptt85 -137.7 -21.68 1.12 Allowed 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -169.026 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.5 t 33.94 79.6 0.28 Allowed Pre-proline 0 N--CA 1.485 1.294 0 C-N-CA 128.551 2.74 . . . . 0.0 114.292 173.127 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.96 170.91 16.86 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.073 2.515 . . . . 0.0 113.437 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.8 p -112.81 51.71 0.81 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.176 1.79 . . . . 0.0 113.94 -163.16 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -77.38 29.02 0.15 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 116.037 1.865 . . . . 0.0 116.037 -178.012 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.42 66.82 8.2 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.849 2.059 . . . . 0.0 111.387 178.666 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 t -145.79 12.52 1.29 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 -172.055 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.04 -89.1 1.03 Allowed Glycine 0 CA--C 1.529 0.927 0 O-C-N 120.761 -1.212 . . . . 0.0 112.628 -176.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -139.11 28.67 2.29 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.775 1.23 . . . . 0.0 113.255 -168.05 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp -131.51 130.8 42.84 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.943 1.297 . . . . 0.0 111.208 176.836 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.4 t -112.86 -77.22 0.58 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 127.42 2.288 . . . . 0.0 111.544 179.53 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -155.7 -40.98 0.08 Allowed 'General case' 0 C--N 1.327 -0.41 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -67.7 -28.76 67.95 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.546 0.739 . . . . 0.0 111.008 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.6 mp0 -71.84 -32.4 67.49 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.812 -0.555 . . . . 0.0 112.35 179.574 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mttt -70.08 -34.84 73.68 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 120.889 -1.132 . . . . 0.0 112.779 170.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -64.46 0.48 1.04 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 169.115 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -112.54 -52.2 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 126.531 1.932 . . . . 0.0 110.924 167.492 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 64.0 t -74.05 -59.97 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.905 0.775 . . . . 0.0 112.275 -175.061 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.05 -28.78 68.49 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.35 -11.32 40.92 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 167.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.04 -36.88 11.36 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.212 1.405 . . . . 0.0 111.299 167.132 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.7 mm -63.72 -27.55 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 O-C-N 120.518 -1.364 . . . . 0.0 112.027 178.915 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.0 p -68.43 -19.83 64.61 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 168.336 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -106.96 -42.06 5.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.173 0.897 . . . . 0.0 113.168 -157.526 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -128.03 -14.67 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.76 -93.33 0.29 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 125.821 1.677 . . . . 0.0 110.173 173.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -164.0 -28.78 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.636 1.574 . . . . 0.0 113.372 175.666 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -108.35 -12.91 14.98 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 114.603 -172.007 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -91.89 -20.18 21.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.121 0.968 . . . . 0.0 112.938 -175.857 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.0 pp -67.87 164.0 20.7 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.637 1.575 . . . . 0.0 112.187 166.62 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.06 171.25 7.78 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.374 1.083 . . . . 0.0 111.946 172.276 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -20.75 32.37 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.102 1.361 . . . . 0.0 113.005 -179.166 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.9 m -67.74 -46.99 70.55 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.835 1.654 . . . . 0.0 111.807 -178.564 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -65.8 -45.13 83.52 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.114 -0.991 . . . . 0.0 112.041 178.769 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -52.48 -56.34 15.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.085 0.554 . . . . 0.0 112.103 168.969 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.8 p -64.69 -21.84 66.84 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.235 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -74.03 -48.66 28.51 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.591 1.557 . . . . 0.0 112.187 173.377 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -76.11 -39.42 55.24 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.89 0.876 . . . . 0.0 112.636 179.762 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.3 mt -81.72 -21.99 37.61 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.094 1.357 . . . . 0.0 113.164 -179.125 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.65 58.5 2.85 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.335 1.454 . . . . 0.0 111.991 -176.764 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.4 pt -123.71 178.44 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 127.68 2.392 . . . . 0.0 109.644 175.358 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -76.59 147.88 37.34 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.494 -0.754 . . . . 0.0 110.843 164.438 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.2 t -53.76 -35.13 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.109 1.363 . . . . 0.0 110.982 175.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.25 -24.22 62.13 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 -176.205 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -78.19 -37.4 45.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.081 0.855 . . . . 0.0 111.253 168.934 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.28 -47.85 75.24 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.701 0.682 . . . . 0.0 110.132 -179.094 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -64.43 -30.78 71.81 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -175.448 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -89.99 -33.25 16.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.906 0.776 . . . . 0.0 112.709 174.899 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.09 -37.09 85.81 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.067 -1.021 . . . . 0.0 112.483 177.772 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -50.32 -63.12 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.361 1.064 . . . . 0.0 110.22 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -63.63 -29.76 70.96 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -179.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -67.38 -23.09 65.55 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.065 0.848 . . . . 0.0 112.885 174.722 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.4 t -82.91 -53.7 5.65 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.915 0.886 . . . . 0.0 111.87 167.771 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.81 91.17 3.52 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.137 1.375 . . . . 0.0 112.875 -170.707 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.98 7.96 9.29 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 126.464 1.906 . . . . 0.0 115.088 -179.385 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.8 mtm -79.12 -22.13 45.6 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -167.291 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.59 90.34 2.13 Favored Glycine 0 N--CA 1.472 1.046 0 C-N-CA 125.66 1.6 . . . . 0.0 111.101 -179.591 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 49.6 mtm-85 31.8 61.97 0.28 Allowed 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 127.384 2.274 . . . . 0.0 113.877 -171.422 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.6 p 52.91 19.18 1.25 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.873 1.669 . . . . 0.0 114.991 177.024 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 46.95 34.14 2.57 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 126.467 1.907 . . . . 0.0 113.564 -167.254 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.4 -9.01 19.76 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -177.475 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -71.48 14.87 0.15 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 127.074 2.149 . . . . 0.0 115.516 -172.805 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -92.23 -4.55 53.93 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.982 2.513 . . . . 0.0 115.048 -166.025 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 57.2 m -145.77 -46.12 0.21 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.103 1.761 . . . . 0.0 110.475 -168.544 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.4 pt -64.65 167.16 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.57 1.148 . . . . 0.0 111.575 173.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 67.07 -9.9 0.35 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 126.496 1.919 . . . . 0.0 115.928 -176.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -143.59 19.65 1.85 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.659 1.118 . . . . 0.0 113.792 -176.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -152.49 -40.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.424 1.089 . . . . 0.0 112.921 -176.144 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -81.12 159.9 24.57 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.847 1.259 . . . . 0.0 112.699 175.742 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -133.78 161.42 34.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.058 1.743 . . . . 0.0 111.745 176.573 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -122.61 153.33 39.45 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.679 1.592 . . . . 0.0 111.498 177.39 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -82.1 -20.7 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.417 1.087 . . . . 0.0 112.237 -175.317 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.7 t 59.33 31.41 21.11 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.613 1.165 . . . . 0.0 112.447 -162.811 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.9 t -144.01 139.15 28.86 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.698 1.599 . . . . 0.0 111.033 173.304 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -154.18 171.69 18.78 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.922 1.689 . . . . 0.0 111.296 -175.391 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 57.4 m -124.28 177.24 5.96 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.051 1.341 . . . . 0.0 111.14 -176.795 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.12 -18.06 56.03 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 176.775 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -139.22 98.19 8.37 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.529 1.931 . . . . 0.0 110.264 167.654 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -74.22 121.56 6.95 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.074 2.516 . . . . 0.0 110.051 173.375 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -134.4 40.66 2.99 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.199 1.4 . . . . 0.0 112.031 -173.57 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.8 tt -120.6 89.53 44.75 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.774 1.63 . . . . 0.0 109.605 -177.707 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo . . . . . 0 C--O 1.254 1.276 0 C-N-CA 124.025 3.15 . . . . 0.0 113.331 -177.848 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.506 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 27.1 m -67.39 159.23 29.88 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.769 1.228 . . . . 0.0 113.628 -179.425 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -127.74 148.41 50.42 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.824 1.65 . . . . 0.0 111.307 173.755 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 31.7 ttm -136.92 37.33 2.59 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.28 1.432 . . . . 0.0 112.596 -175.145 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -124.08 -59.69 1.48 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.684 1.593 . . . . 0.0 111.777 178.035 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.34 17.68 3.0 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 174.997 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.2 mtp -146.9 -13.69 0.42 Allowed 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -179.456 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -114.11 4.96 15.81 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.747 1.619 . . . . 0.0 112.761 178.302 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.65 39.79 0.73 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.03 1.332 . . . . 0.0 112.285 -163.518 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -109.53 127.16 54.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.384 1.474 . . . . 0.0 110.934 178.799 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -156.57 15.99 0.31 Allowed 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -173.34 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -122.18 17.03 10.74 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 120.539 -1.351 . . . . 0.0 114.454 -167.841 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 82.6 mt -98.87 98.56 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.96 1.304 . . . . 0.0 110.034 -165.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 6.1 mt -138.87 54.32 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 125.172 1.389 . . . . 0.0 110.669 -172.892 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -135.18 50.78 2.12 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.061 1.344 . . . . 0.0 112.29 -176.099 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -144.77 130.15 18.78 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.581 1.152 . . . . 0.0 112.719 -174.402 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.3 pp -150.53 145.75 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 127.713 2.405 . . . . 0.0 111.079 177.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -129.59 26.68 5.31 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.481 1.912 . . . . 0.0 113.946 -178.846 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm 51.83 60.29 3.95 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.792 -1.193 . . . . 0.0 111.943 -172.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -57.77 107.14 0.42 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.585 1.554 . . . . 0.0 112.844 -173.829 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -92.93 43.44 1.12 Allowed 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.158 -1.383 . . . . 0.0 113.504 -164.247 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.8 mt 52.89 40.22 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 125.687 1.595 . . . . 0.0 110.888 -168.767 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.4 p30 -107.82 -9.28 15.79 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.897 1.679 . . . . 0.0 112.808 -179.486 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 51.7 p -113.04 -51.67 2.82 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.404 1.481 . . . . 0.0 112.568 -171.953 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -66.76 -23.39 66.07 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.749 1.62 . . . . 0.0 114.813 -179.638 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 69.2 t -90.82 -25.28 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.544 1.538 . . . . 0.0 112.041 175.845 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.4 t -117.66 62.2 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 125.327 1.451 . . . . 0.0 110.371 -172.11 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 tp -142.43 138.69 31.25 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.759 1.224 . . . . 0.0 111.684 179.319 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 tttt -139.14 33.22 2.13 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.072 1.749 . . . . 0.0 112.946 -177.096 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 t30 46.41 67.29 4.51 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 126.967 2.107 . . . . 0.0 113.688 -177.601 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -77.74 45.52 1.79 Allowed 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 124.898 3.732 . . . . 0.0 114.338 -170.969 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.7 mmt85 -134.28 27.22 3.8 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 127.632 2.373 . . . . 0.0 113.64 -172.43 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.1 t -115.11 78.41 5.69 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 125.444 1.497 . . . . 0.0 111.415 178.086 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -80.74 165.21 20.23 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.817 3.011 . . . . 0.0 112.87 174.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 p -86.57 56.86 4.19 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.49 1.516 . . . . 0.0 112.048 171.11 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 56.07 31.64 18.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.229 1.812 . . . . 0.0 114.097 174.219 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.91 35.45 1.15 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.066 1.747 . . . . 0.0 113.401 -171.378 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.1 t -147.03 19.52 1.25 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.534 1.133 . . . . 0.0 113.725 -165.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.7 -69.92 1.3 Allowed Glycine 0 CA--C 1.533 1.162 0 O-C-N 120.567 -1.333 . . . . 0.0 112.895 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -136.97 -63.4 0.61 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.101 1.36 . . . . 0.0 111.439 177.636 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 mp -114.19 115.46 27.51 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 127.19 2.196 . . . . 0.0 109.593 179.848 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 85.1 p -97.76 -71.4 0.69 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.641 1.176 . . . . 0.0 111.667 169.026 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -163.67 -34.31 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 124.575 1.15 . . . . 0.0 111.666 -168.354 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.83 -32.81 46.32 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.819 -0.55 . . . . 0.0 111.705 173.742 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -75.09 -39.16 60.94 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.174 -0.954 . . . . 0.0 112.527 -170.077 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -67.66 -28.51 67.76 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.27 -0.894 . . . . 0.0 112.406 172.787 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -67.5 -6.88 21.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 168.476 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -101.56 -39.72 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.012 1.325 . . . . 0.0 111.052 170.825 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.6 t -90.48 -54.15 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 119.059 0.845 . . . . 0.0 113.141 -174.563 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.14 -35.66 81.5 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.104 0.865 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.26 -33.43 71.03 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.22 -38.09 60.83 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.095 -1.003 . . . . 0.0 111.767 176.442 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -61.84 -26.99 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 120.858 -1.151 . . . . 0.0 111.229 173.009 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.4 m -79.51 -12.13 59.88 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 170.187 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.7 -39.5 6.32 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.622 1.101 . . . . 0.0 112.821 -172.462 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -132.64 -15.53 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -171.58 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.37 -82.1 0.34 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 125.417 1.484 . . . . 0.0 111.62 171.377 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 35.6 tp -171.66 -34.51 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.471 1.908 . . . . 0.0 111.236 177.026 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -107.69 -5.59 17.33 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -167.05 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -99.09 -22.46 15.68 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -62.65 157.94 19.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.917 1.287 . . . . 0.0 112.612 171.02 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.56 172.67 6.78 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.493 1.139 . . . . 0.0 112.094 177.617 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -18.55 30.27 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.988 1.315 . . . . 0.0 112.739 -179.058 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.7 m -66.5 -50.24 63.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.689 1.596 . . . . 0.0 111.417 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -65.92 -45.37 82.14 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.964 -1.085 . . . . 0.0 111.973 179.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mp -53.25 -52.73 58.06 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.763 0.825 . . . . 0.0 112.862 170.035 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.7 p -63.6 -28.22 69.78 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 120.738 -1.226 . . . . 0.0 113.669 -179.351 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -75.81 -44.24 42.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.3 1.44 . . . . 0.0 112.783 177.312 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.6 mmt-85 -86.89 -39.21 16.02 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.586 1.154 . . . . 0.0 113.742 -176.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -85.06 -17.74 36.49 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.691 1.597 . . . . 0.0 111.663 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 61.66 64.14 1.07 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.978 1.711 . . . . 0.0 111.825 178.892 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 16.0 pt -132.53 162.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 127.547 2.339 . . . . 0.0 109.104 178.502 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.1 t -68.35 149.92 48.81 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.495 -0.753 . . . . 0.0 110.338 166.87 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.4 t -57.43 -34.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.987 0.915 . . . . 0.0 111.078 -177.853 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.35 -33.12 73.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 178.781 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -67.72 -35.44 78.77 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.915 0.78 . . . . 0.0 111.181 171.317 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.82 -48.78 62.7 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.796 0.726 . . . . 0.0 110.615 176.421 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -57.81 -32.11 67.24 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.564 1.546 . . . . 0.0 113.665 179.051 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.1 t -89.71 -43.18 10.88 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.024 0.829 . . . . 0.0 113.003 174.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -58.75 -36.95 75.18 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.76 1.164 . . . . 0.0 113.129 -177.988 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mt -48.96 -48.09 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 125.063 1.345 . . . . 0.0 111.731 173.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -91.66 -25.34 19.18 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 179.438 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -72.44 -31.56 65.56 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 119.397 0.999 . . . . 0.0 112.38 179.493 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t -84.39 -38.1 20.69 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.361 1.064 . . . . 0.0 113.464 177.725 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -116.22 -29.06 6.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 115.03 1.493 . . . . 0.0 115.03 -169.073 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.6 tpp85 46.87 42.63 12.38 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 128.345 2.658 . . . . 0.0 115.328 -177.868 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.5 mpt? 63.27 -35.89 0.14 Allowed 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 127.888 2.475 . . . . 0.0 115.802 -179.717 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 140.91 -66.5 0.5 Allowed Glycine 0 N--CA 1.468 0.828 0 C-N-CA 126.068 1.794 . . . . 0.0 111.329 163.729 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.2 11.44 4.2 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.652 1.581 . . . . 0.0 113.72 174.075 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.6 m -57.56 -43.5 84.55 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.011 0.924 . . . . 0.0 113.378 -175.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -153.11 28.09 0.52 Allowed 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.418 168.935 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -111.85 33.58 4.71 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.979 1.712 . . . . 0.0 111.967 -172.511 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -124.99 17.52 8.52 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.764 1.626 . . . . 0.0 113.21 -173.808 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -76.82 -6.17 51.23 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.107 2.163 . . . . 0.0 115.873 -175.593 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.0 t -137.17 -38.63 0.61 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.434 1.494 . . . . 0.0 112.137 177.146 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.1 mt -63.23 157.85 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.299 1.44 . . . . 0.0 109.178 167.615 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.5 -24.2 0.06 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 127.321 2.248 . . . . 0.0 116.858 -177.29 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -101.83 -25.71 13.72 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.122 1.369 . . . . 0.0 114.439 175.894 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.08 -4.68 59.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 171.387 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -88.98 149.79 23.12 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.513 1.525 . . . . 0.0 112.077 -178.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -142.01 34.73 1.55 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.562 1.145 . . . . 0.0 113.213 -171.287 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -81.73 144.31 31.22 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.746 -1.221 . . . . 0.0 112.46 177.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.1 t -130.3 -48.67 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.724 1.21 . . . . 0.0 111.703 -178.608 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 68.0 p -113.4 4.53 16.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.445 1.498 . . . . 0.0 114.205 -176.654 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 t -110.58 7.07 22.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.354 1.462 . . . . 0.0 114.507 -169.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.42 128.54 35.21 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.882 -1.136 . . . . 0.0 112.059 178.92 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 73.8 m -153.42 131.33 11.71 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.816 1.647 . . . . 0.0 109.616 -179.093 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.28 33.93 13.66 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.818 1.247 . . . . 0.0 114.243 -177.11 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -124.05 63.98 33.21 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.755 1.622 . . . . 0.0 113.428 178.128 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -80.03 51.05 3.74 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 124.496 3.464 . . . . 0.0 113.39 -179.469 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -105.97 77.46 1.25 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.407 1.483 . . . . 0.0 110.269 -179.794 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 92.0 mt -117.79 152.34 49.82 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 125.98 1.712 . . . . 0.0 111.911 178.552 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 C--O 1.253 1.253 0 C-N-CA 124.011 3.141 . . . . 0.0 113.388 178.19 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 112.026 -0.43 . . . . 0.0 112.026 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 8.2 t -147.56 164.48 33.31 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.383 1.473 . . . . 0.0 111.492 177.427 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -134.52 123.73 24.39 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.083 1.353 . . . . 0.0 110.626 178.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 65.3 mtt -124.53 109.98 13.9 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.968 1.307 . . . . 0.0 110.447 178.645 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.26 -67.75 0.69 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.955 1.302 . . . . 0.0 111.881 175.503 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.2 t 53.87 28.28 8.24 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.547 1.539 . . . . 0.0 114.901 178.445 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.64 -18.72 0.16 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -179.708 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -112.4 13.53 20.26 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.671 1.588 . . . . 0.0 112.837 -179.502 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.8 33.16 0.84 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.193 1.797 . . . . 0.0 111.335 -168.83 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.8 mp -117.39 168.08 10.68 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.263 1.825 . . . . 0.0 111.196 -179.811 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -129.56 2.7 5.02 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.169 1.388 . . . . 0.0 113.772 -175.433 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -89.26 12.42 16.08 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.408 1.483 . . . . 0.0 114.706 -175.64 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -73.05 132.56 33.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 124.677 1.191 . . . . 0.0 111.276 -174.54 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 73.4 mt -132.92 138.47 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.028 1.731 . . . . 0.0 109.327 178.044 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -135.8 167.09 21.82 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.901 1.68 . . . . 0.0 111.734 179.074 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -131.6 175.4 9.2 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.081 1.352 . . . . 0.0 112.626 -179.347 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.9 tt -65.8 -26.21 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 C-N-CA 125.27 1.428 . . . . 0.0 114.697 -177.461 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 53.89 42.27 31.77 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.305 1.442 . . . . 0.0 113.854 178.12 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -92.38 -19.36 22.16 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.12 1.368 . . . . 0.0 112.548 176.155 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 58.05 40.25 25.53 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.212 1.805 . . . . 0.0 114.535 174.412 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.71 -62.16 2.0 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.354 1.462 . . . . 0.0 114.386 -172.423 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 50.1 mt -129.46 -11.78 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.693 1.197 . . . . 0.0 113.602 -172.574 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -74.56 -15.17 60.86 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -173.274 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.3 t -81.45 -53.39 6.33 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.665 0.786 . . . . 0.0 112.492 178.147 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -68.1 -18.19 64.58 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -172.623 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.7 t -78.08 -22.91 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.152 1.381 . . . . 0.0 111.832 174.241 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.9 t -129.56 53.06 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.675 1.59 . . . . 0.0 110.933 -171.438 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.2 mt -132.07 152.17 51.35 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.588 1.555 . . . . 0.0 112.109 175.068 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -122.37 32.0 5.94 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 126.478 1.911 . . . . 0.0 112.573 -175.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 t30 48.97 59.18 17.45 Favored Pre-proline 0 CA--C 1.559 1.295 0 C-N-CA 126.924 2.09 . . . . 0.0 113.877 -174.476 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -77.94 78.21 3.65 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.844 3.029 . . . . 0.0 112.551 -174.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -129.58 -59.5 1.08 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.159 1.384 . . . . 0.0 113.477 176.142 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 p -153.96 116.47 2.61 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 124.82 1.248 . . . . 0.0 110.946 -174.356 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -86.28 159.1 9.73 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 123.367 2.711 . . . . 0.0 112.709 176.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 p -82.9 58.78 4.51 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.93 1.692 . . . . 0.0 112.254 174.822 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 56.75 25.61 10.43 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.647 1.979 . . . . 0.0 114.911 178.347 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.35 34.93 0.26 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.442 1.897 . . . . 0.0 113.569 -172.58 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.5 t -137.0 8.19 2.97 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -162.886 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -164.28 36.88 0.3 Allowed Glycine 0 CA--C 1.535 1.305 0 O-C-N 120.857 -1.152 . . . . 0.0 114.339 -175.555 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -93.39 24.06 4.15 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.106 1.362 . . . . 0.0 114.281 -166.409 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 56.66 82.17 0.12 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 127.875 2.47 . . . . 0.0 114.172 169.099 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 t -76.96 -79.56 0.11 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.503 1.121 . . . . 0.0 112.886 -173.39 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.47 -44.06 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.579 0.752 . . . . 0.0 111.403 -170.754 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -72.57 -28.34 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.027 0.531 . . . . 0.0 111.08 171.797 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -72.36 -49.73 32.01 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.448 1.099 . . . . 0.0 112.043 -171.167 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -65.37 -25.47 67.58 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.304 -1.497 . . . . 0.0 113.481 172.188 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -66.95 -5.54 13.12 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 167.478 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.31 -52.68 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.121 1.368 . . . . 0.0 110.043 167.153 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.8 t -79.41 -51.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.039 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.41 -32.95 74.18 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 118.982 0.81 . . . . 0.0 110.948 179.065 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.03 -36.35 74.82 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 167.773 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -40.67 70.34 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.123 -0.986 . . . . 0.0 111.776 175.72 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.2 -31.16 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 O-C-N 120.86 -1.15 . . . . 0.0 111.133 172.233 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -72.79 -17.23 61.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 171.693 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -102.49 -42.72 5.86 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.725 -1.234 . . . . 0.0 112.641 -170.665 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.98 -12.86 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -171.871 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.21 -82.54 0.34 Allowed Glycine 0 N--CA 1.469 0.852 0 C-N-CA 125.389 1.471 . . . . 0.0 112.59 167.095 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 65.5 tp -167.64 -36.27 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.263 1.825 . . . . 0.0 111.666 -179.117 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -112.29 -10.14 13.83 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.189 1.396 . . . . 0.0 114.645 -167.475 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -93.43 -15.31 25.75 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.158 0.983 . . . . 0.0 112.886 179.233 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -71.78 164.92 25.11 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.23 1.412 . . . . 0.0 113.533 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -110.13 118.63 36.9 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.637 1.175 . . . . 0.0 111.626 -179.501 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.7 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.639 1.176 . . . . 0.0 113.389 176.501 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.8 m -69.43 -41.38 76.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.313 -0.867 . . . . 0.0 111.543 173.543 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -61.3 -41.26 96.69 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.796 -1.19 . . . . 0.0 111.736 172.71 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.87 -46.32 81.89 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.675 -0.64 . . . . 0.0 111.795 168.787 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.1 p -60.59 -22.41 63.68 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.516 -1.365 . . . . 0.0 113.887 178.821 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -94.66 -43.04 8.46 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.114 1.766 . . . . 0.0 112.064 -175.492 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.4 mmt85 -79.22 -37.61 37.69 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.249 1.419 . . . . 0.0 112.835 176.872 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tp -98.88 -12.02 21.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.956 1.702 . . . . 0.0 113.544 -173.064 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.76 55.62 4.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.116 1.367 . . . . 0.0 112.643 176.218 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 10.1 pt -123.23 163.98 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 126.971 2.108 . . . . 0.0 110.731 174.913 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 58.8 m -57.88 139.44 54.2 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.711 1.204 . . . . 0.0 110.394 163.149 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -61.22 -33.82 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 O-C-N 121.116 -0.99 . . . . 0.0 111.642 -179.547 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -72.76 -31.98 65.29 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.34 -0.85 . . . . 0.0 112.946 176.281 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.27 -39.56 94.92 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.683 167.121 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.18 -49.78 72.91 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.147 0.885 . . . . 0.0 110.896 178.745 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -33.95 73.38 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -179.737 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -86.12 -40.52 15.6 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.348 0.976 . . . . 0.0 112.825 175.689 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.45 -37.39 75.33 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.974 1.31 . . . . 0.0 113.056 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.3 mt -49.05 -39.8 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.953 1.301 . . . . 0.0 111.708 171.785 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -90.25 -32.5 16.53 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.718 1.207 . . . . 0.0 113.531 178.333 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -66.19 -34.53 78.24 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.688 0.676 . . . . 0.0 111.842 -176.633 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.8 m -82.44 -39.39 22.64 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 176.487 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -156.42 79.15 0.95 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -171.724 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.5 ptt-85 -97.94 10.78 39.44 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.895 1.678 . . . . 0.0 115.016 170.506 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 85.3 mtp -64.04 -27.33 69.04 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -157.85 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 172.46 -69.01 0.11 Allowed Glycine 0 N--CA 1.469 0.859 0 CA-C-N 119.358 0.981 . . . . 0.0 111.436 161.608 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 70.9 mtp85 -113.17 -91.86 0.49 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.564 1.546 . . . . 0.0 109.173 166.868 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 62.4 p -139.92 37.2 1.96 Allowed 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.346 1.058 . . . . 0.0 113.461 -173.811 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 61.29 19.36 10.07 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.836 1.654 . . . . 0.0 113.451 -176.045 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -82.08 -13.22 57.61 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.583 1.953 . . . . 0.0 113.974 -178.483 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -74.17 14.71 0.39 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.642 1.977 . . . . 0.0 114.83 -172.097 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -80.24 -19.12 47.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.397 1.479 . . . . 0.0 112.974 -170.79 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.3 m -122.72 -39.07 2.56 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.599 1.96 . . . . 0.0 111.477 -172.834 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.4 mt -67.27 158.82 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.559 1.144 . . . . 0.0 108.415 165.131 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.6 ttmm 67.51 -10.58 0.35 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 167.644 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.3 ptt? -83.6 -26.37 30.06 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.113 0.869 . . . . 0.0 113.162 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 p90 -121.57 -10.83 8.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.844 1.258 . . . . 0.0 114.359 -175.172 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -85.04 133.52 34.24 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.64 1.176 . . . . 0.0 111.788 -176.871 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -151.48 110.58 3.9 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.079 1.351 . . . . 0.0 110.627 177.36 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 55.6 176.28 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.515 1.926 . . . . 0.0 114.798 -168.399 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 96.7 t -99.43 -19.19 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.001 1.32 . . . . 0.0 111.471 178.659 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 34.9 m 57.65 22.69 8.56 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.768 1.627 . . . . 0.0 113.716 -168.14 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 19.1 t -154.77 144.01 21.16 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.96 1.704 . . . . 0.0 110.482 173.47 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -154.65 166.43 33.4 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.452 1.501 . . . . 0.0 111.7 -176.001 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.4 t -106.68 178.52 4.54 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.86 1.264 . . . . 0.0 111.196 175.136 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.54 -31.87 71.91 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 174.396 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -148.61 150.74 34.34 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.696 1.998 . . . . 0.0 111.717 174.012 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.63 92.52 1.02 Allowed 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.658 2.906 . . . . 0.0 112.313 -176.044 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 54.39 37.63 27.99 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.511 1.924 . . . . 0.0 113.445 177.597 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.6 tt -126.14 97.27 35.16 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.405 1.482 . . . . 0.0 109.717 -171.159 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo . . . . . 0 C--O 1.253 1.252 0 C-N-CA 124.055 3.17 . . . . 0.0 113.455 -175.723 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.547 0.857 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.9 m -93.17 -73.13 0.57 Allowed 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.186 -0.946 . . . . 0.0 113.061 -168.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -162.61 -45.68 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.939 0.496 . . . . 0.0 111.432 -174.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.77 -33.89 76.61 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.641 0.777 . . . . 0.0 110.577 174.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.0 -38.75 83.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.602 1.161 . . . . 0.0 111.375 -176.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -64.89 -37.76 88.7 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 172.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -66.12 -2.42 4.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 171.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.6 mt -105.21 -53.29 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.104 1.362 . . . . 0.0 110.432 165.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.3 t -69.96 -64.06 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.059 0.845 . . . . 0.0 111.817 -173.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.62 -30.74 68.55 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 111.704 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -55.87 -36.93 68.14 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 166.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.34 -37.9 60.45 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.241 1.016 . . . . 0.0 112.311 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mm -61.5 -30.96 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 121.044 -1.035 . . . . 0.0 110.501 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 t -72.81 -17.0 61.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.91 1.284 . . . . 0.0 114.286 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -101.38 -42.66 6.2 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.601 -1.312 . . . . 0.0 112.745 -169.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.6 m -129.04 -13.31 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -169.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.88 -78.26 0.38 Allowed Glycine 0 N--CA 1.47 0.915 0 C-N-CA 125.187 1.375 . . . . 0.0 112.198 165.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tp -160.6 -45.87 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.592 1.157 . . . . 0.0 112.287 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -109.74 -8.28 14.95 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.801 1.64 . . . . 0.0 114.28 -167.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -88.72 -14.29 37.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.873 0.869 . . . . 0.0 112.852 -175.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -66.52 166.67 12.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.724 1.21 . . . . 0.0 112.082 164.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -119.09 165.16 14.5 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 122.427 1.108 . . . . 0.0 111.716 170.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.89 -26.78 59.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.551 1.14 . . . . 0.0 112.679 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -65.38 -46.06 81.56 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 112.123 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -67.37 -27.92 67.52 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.578 -1.326 . . . . 0.0 113.088 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.37 -56.92 6.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.201 1.0 . . . . 0.0 111.695 167.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.2 p -60.3 -26.68 66.7 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.565 1.146 . . . . 0.0 113.703 -177.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -70.37 -27.41 64.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.12 1.368 . . . . 0.0 113.74 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -114.08 -31.57 6.31 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.753 1.221 . . . . 0.0 113.454 -174.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.3 mt -84.69 -19.03 33.45 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.413 1.485 . . . . 0.0 112.723 173.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.53 22.38 12.09 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 126.166 1.786 . . . . 0.0 114.164 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.5 pt -73.64 164.84 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.963 1.705 . . . . 0.0 110.538 163.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 70' ' ' LYS . 15.3 t -76.34 156.8 33.01 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.512 -0.742 . . . . 0.0 110.946 166.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.09 -38.37 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.01 0.924 . . . . 0.0 111.487 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -70.08 -31.39 68.96 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.405 ' H ' HG23 ' A' ' 67' ' ' THR . 77.6 mttt -67.93 -36.67 80.55 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.076 168.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.05 -47.33 71.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.445 1.02 . . . . 0.0 111.196 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.9 mtpt -55.3 -43.38 74.77 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.536 1.534 . . . . 0.0 112.631 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -82.5 -38.23 24.14 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.8 -39.3 73.88 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.866 -1.146 . . . . 0.0 112.59 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.9 mt -48.94 -65.98 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.338 1.455 . . . . 0.0 110.453 173.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -64.91 -27.14 68.65 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 . . . . . 0 CA--C 1.54 0.584 0 CA-C-N 119.463 1.029 . . . . 0.0 112.841 -177.106 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.4 4.93 0.38 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.688 1.995 . . . . 0.0 115.575 -172.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.57 -10.84 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 120.145 -1.597 . . . . 0.0 113.647 -173.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -68.03 9.25 0.32 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.12 2.168 . . . . 0.0 115.352 -176.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -92.01 -6.0 51.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 128.611 2.764 . . . . 0.0 114.234 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.2 m -141.47 -45.66 0.37 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.138 1.775 . . . . 0.0 110.489 -170.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.0 pt -64.09 168.12 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 123.689 0.796 . . . . 0.0 111.193 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? 69.06 -14.94 0.28 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 126.694 1.998 . . . . 0.0 116.241 -177.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.39 19.72 2.39 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 120.414 1.461 . . . . 0.0 114.777 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -142.94 -24.58 0.62 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.169 1.544 . . . . 0.0 115.169 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 . . . . . 0 CA--C 1.542 0.673 0 O-C-N 121.228 -0.92 . . . . 0.0 111.728 -178.654 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.1 m -95.5 -69.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.284 . . . . 0.0 112.729 -168.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -161.72 -43.42 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -172.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -73.4 -26.05 60.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.139 0.576 . . . . 0.0 110.59 175.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 -69.73 -41.57 75.13 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.357 1.463 . . . . 0.0 110.391 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -62.47 -36.27 81.94 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.807 0.843 . . . . 0.0 112.834 168.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -65.37 -3.97 4.91 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.6 mt -109.29 -20.59 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.834 1.654 . . . . 0.0 112.393 173.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.6 t -122.89 -53.88 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 CA-C-N 119.463 1.028 . . . . 0.0 113.634 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.83 -33.34 73.97 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.616 1.098 . . . . 0.0 110.948 171.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.76 -43.88 97.42 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.874 0.87 . . . . 0.0 113.055 167.255 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -36.24 78.16 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.624 1.17 . . . . 0.0 112.131 -178.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.95 -24.62 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 124.883 1.273 . . . . 0.0 111.649 171.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -80.56 -16.86 53.16 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.025 1.121 . . . . 0.0 114.025 171.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -94.82 -50.65 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.668 -1.27 . . . . 0.0 112.009 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 m -123.53 -13.84 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -167.408 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 124.2 -75.42 0.39 Allowed Glycine 0 N--CA 1.469 0.888 0 C-N-CA 125.328 1.442 . . . . 0.0 112.913 163.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.5 tp -166.78 -40.74 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.437 1.495 . . . . 0.0 112.206 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -111.05 -5.19 14.84 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -168.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -93.48 -17.99 22.8 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.101 0.961 . . . . 0.0 112.99 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -68.29 163.82 22.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.782 1.233 . . . . 0.0 112.096 165.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -116.78 169.75 9.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 122.454 1.121 . . . . 0.0 111.645 172.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.03 -24.44 40.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.308 1.043 . . . . 0.0 112.651 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.0 m -65.26 -45.3 85.06 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.802 1.641 . . . . 0.0 112.292 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.94 -38.23 90.28 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.517 -1.365 . . . . 0.0 111.931 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.3 -51.09 71.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.5 0.72 . . . . 0.0 112.167 172.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.5 p -65.51 -31.11 71.99 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.699 0.799 . . . . 0.0 113.116 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -70.87 -41.71 71.04 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.29 1.436 . . . . 0.0 112.602 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -96.19 -35.14 11.4 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.484 1.113 . . . . 0.0 113.416 -169.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 tt -91.64 -17.29 25.75 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.14 1.776 . . . . 0.0 112.099 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 61.01 69.96 0.64 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.212 1.805 . . . . 0.0 112.712 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.9 pt -136.79 162.89 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 128.384 2.674 . . . . 0.0 109.136 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -70.15 152.53 44.19 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.382 -0.824 . . . . 0.0 111.038 167.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 t -58.92 -36.07 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.052 0.941 . . . . 0.0 111.379 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.84 -32.26 71.82 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -69.14 -35.52 76.46 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.592 -0.718 . . . . 0.0 111.117 171.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.25 -49.74 63.23 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.767 0.712 . . . . 0.0 110.568 175.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -54.11 -42.91 69.94 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.506 1.522 . . . . 0.0 112.563 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -87.02 -32.18 20.15 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -63.04 -37.77 88.51 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.505 -1.372 . . . . 0.0 112.25 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.6 mt -49.79 -44.77 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.624 1.17 . . . . 0.0 111.739 175.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -90.0 -25.2 20.98 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 . . . . . 0 CA--C 1.543 0.696 0 CA-C-N 119.848 1.204 . . . . 0.0 112.627 174.085 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.482 1.173 0 CA-C-O 121.811 0.815 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 m120 52.61 30.8 9.12 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.514 1.526 . . . . 0.0 114.739 -175.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.94 -1.01 38.31 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -68.7 13.75 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.628 1.971 . . . . 0.0 115.758 -175.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.7 pttt -91.65 -6.54 51.97 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.075 2.55 . . . . 0.0 114.318 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 90.0 m -136.93 -42.09 0.59 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.808 1.643 . . . . 0.0 111.393 -173.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.7 pt -69.42 169.43 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 123.738 0.815 . . . . 0.0 111.384 170.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 67.53 -29.17 0.15 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.199 2.199 . . . . 0.0 115.791 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.2 ptp -94.29 -34.89 12.67 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.648 1.179 . . . . 0.0 113.606 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -90.0 -25.67 20.74 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 173.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 CA--C 1.54 0.585 0 C-N-CA 124.162 0.985 . . . . 0.0 111.924 -173.375 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 C--O 1.234 0.277 0 CA-C-O 121.593 0.711 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.9 m -114.46 -73.25 0.66 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.904 1.682 . . . . 0.0 112.855 -176.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -160.17 -32.38 0.06 Allowed 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -170.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -83.15 -27.43 30.1 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.909 0.484 . . . . 0.0 111.226 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -75.4 -42.81 52.86 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.815 1.246 . . . . 0.0 111.437 -169.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -70.8 -26.69 63.43 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.995 0.918 . . . . 0.0 112.61 174.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -66.54 -4.71 9.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 166.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.1 mt -107.09 -52.83 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.14 1.376 . . . . 0.0 110.258 166.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.82 -57.85 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.231 0.923 . . . . 0.0 111.581 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.64 67.82 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.366 0.53 . . . . 0.0 111.777 -177.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -57.85 -36.92 72.97 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 167.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -38.19 70.34 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.195 0.998 . . . . 0.0 111.852 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -58.81 -35.01 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 O-C-N 120.24 -1.538 . . . . 0.0 110.749 174.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.2 m -77.15 -4.94 47.13 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -107.26 -29.94 9.02 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.936 1.244 . . . . 0.0 113.436 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.3 p -136.21 -22.22 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 -171.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 140.05 -86.31 0.21 Allowed Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.663 1.125 . . . . 0.0 111.801 174.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.5 tp -159.54 -42.98 0.05 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.844 1.258 . . . . 0.0 112.397 174.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -117.3 2.92 12.58 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -168.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -94.95 -17.04 22.33 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.295 0.638 . . . . 0.0 112.281 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.98 161.73 18.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.122 1.369 . . . . 0.0 112.087 168.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -110.78 162.3 14.91 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.564 1.173 . . . . 0.0 111.557 168.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.81 -24.94 48.64 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.614 1.166 . . . . 0.0 112.584 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.2 m -64.02 -47.17 81.31 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.907 1.683 . . . . 0.0 111.731 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -62.59 -40.47 97.01 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.753 1.221 . . . . 0.0 113.074 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.51 -51.53 69.07 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.051 0.94 . . . . 0.0 111.278 168.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.1 m -58.76 -30.38 67.48 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.341 1.456 . . . . 0.0 113.167 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -79.4 -18.52 52.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.554 1.542 . . . . 0.0 113.511 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -110.04 -36.66 5.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.194 1.398 . . . . 0.0 113.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.24 -19.57 46.58 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.364 1.066 . . . . 0.0 112.663 171.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.12 63.12 1.48 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.175 1.39 . . . . 0.0 111.366 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.6 pt -128.34 167.28 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.544 1.938 . . . . 0.0 111.947 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.1 m -65.06 134.53 54.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.954 1.702 . . . . 0.0 109.551 165.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.77 -34.37 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 122.992 0.517 . . . . 0.0 111.742 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.2 -28.76 66.66 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 177.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -68.87 -36.95 78.72 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.272 170.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.62 -49.08 61.98 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.704 0.684 . . . . 0.0 110.437 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -53.31 -42.63 66.87 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.119 1.368 . . . . 0.0 112.594 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -87.79 -32.63 18.98 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -62.62 -38.96 92.27 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.179 -0.951 . . . . 0.0 112.228 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.6 mt -48.06 -65.6 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.013 1.325 . . . . 0.0 109.851 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.76 -28.64 67.79 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 . . . . . 0 N--CA 1.474 0.732 0 CA-C-N 120.027 1.285 . . . . 0.0 113.152 178.251 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.259 0.8 OUTLIER 46.11 26.67 0.45 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.765 2.026 . . . . 0.0 115.977 -170.589 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -8.28 25.42 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.719 1.208 . . . . 0.0 114.155 -175.159 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -72.83 15.52 0.19 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.442 1.897 . . . . 0.0 115.058 -174.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -89.32 -5.13 57.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.093 2.557 . . . . 0.0 114.726 -169.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 93.8 m -138.19 -50.47 0.58 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.206 1.802 . . . . 0.0 109.954 -171.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.2 pt -66.9 165.08 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.813 1.245 . . . . 0.0 112.279 172.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.57 -7.2 0.19 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.452 2.301 . . . . 0.0 116.018 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 47.3 mtm -93.23 -44.1 8.5 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.875 1.216 . . . . 0.0 113.518 -178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -109.85 -6.05 15.35 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 . . . . . 0 CA--C 1.542 0.654 0 C-N-CA 125.052 1.341 . . . . 0.0 112.289 177.33 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.6 mp . . . . . 0 CA--C 1.537 0.459 0 CA-C-O 121.54 0.686 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 p -95.75 -87.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.657 1.983 . . . . 0.0 111.722 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -159.34 -36.96 0.06 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.494 1.118 . . . . 0.0 112.567 -172.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.44 -33.26 73.88 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.755 0.822 . . . . 0.0 110.471 168.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -72.23 -31.31 65.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.455 1.102 . . . . 0.0 111.404 -175.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -42.49 99.38 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.291 1.036 . . . . 0.0 113.722 165.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -60.42 -9.38 3.54 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 172.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.5 mt -99.26 -57.27 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.14 1.376 . . . . 0.0 111.153 166.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.29 -55.63 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 119.573 1.078 . . . . 0.0 112.8 -172.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.04 -32.67 74.5 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.674 -0.641 . . . . 0.0 111.056 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.76 -34.26 76.86 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -36.5 63.72 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.563 1.145 . . . . 0.0 111.703 174.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.89 -33.82 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.138 -1.601 . . . . 0.0 110.389 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.1 m -79.75 -3.54 48.01 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 170.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -101.27 -40.39 7.16 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.996 1.271 . . . . 0.0 112.501 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 p -132.98 -22.8 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 -169.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 142.98 -84.9 0.19 Allowed Glycine 0 N--CA 1.469 0.883 0 C-N-CA 124.559 1.076 . . . . 0.0 111.517 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -165.6 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 111.302 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -104.85 -9.31 18.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.591 1.556 . . . . 0.0 114.771 -166.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -92.17 -16.95 25.57 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.66 0.664 . . . . 0.0 112.713 -174.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.93 161.21 18.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.334 1.454 . . . . 0.0 114.521 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.1 t-20 -100.95 123.4 45.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.011 1.324 . . . . 0.0 110.948 -177.132 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.55 -28.84 70.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.673 1.189 . . . . 0.0 113.022 177.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.2 m -68.33 -42.63 79.03 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.555 0.742 . . . . 0.0 111.671 176.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -62.2 -37.83 86.82 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.37 -0.831 . . . . 0.0 112.382 175.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.38 -47.37 84.45 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.692 -0.63 . . . . 0.0 111.868 168.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -60.28 -27.16 67.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -76.0 -26.65 56.93 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.252 1.821 . . . . 0.0 112.941 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -105.18 -37.62 6.84 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.367 1.467 . . . . 0.0 112.885 -177.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -17.14 53.31 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.417 1.087 . . . . 0.0 112.453 173.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 59.49 60.23 2.35 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.205 1.402 . . . . 0.0 112.079 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.6 pt -128.76 175.76 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 127.971 2.509 . . . . 0.0 109.645 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.498 HG23 ' H ' ' A' ' 70' ' ' LYS . 10.1 t -77.09 148.64 35.97 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.407 -0.808 . . . . 0.0 110.675 163.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.93 -29.78 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.37 1.068 . . . . 0.0 111.153 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -70.63 -29.65 66.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.498 ' H ' HG23 ' A' ' 67' ' ' THR . 91.0 mttt -73.87 -37.13 64.84 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.818 -0.61 . . . . 0.0 111.183 167.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.88 -47.07 76.06 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.425 0.557 . . . . 0.0 111.006 -177.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 53.8 pttt -70.6 -20.49 62.76 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -176.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -93.41 -39.27 11.01 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.085 0.857 . . . . 0.0 112.336 171.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.69 -42.57 75.39 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.139 -0.976 . . . . 0.0 112.292 177.147 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mt -47.39 -63.98 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.699 1.2 . . . . 0.0 110.455 175.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.3 pttt -73.37 -32.52 64.55 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 CA--C 1.537 0.462 0 CA-C-N 118.801 0.728 . . . . 0.0 112.295 -177.364 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.68 31.91 13.62 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 114.3 -174.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.81 -9.26 23.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.778 1.231 . . . . 0.0 113.977 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -75.79 15.88 0.46 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.482 1.913 . . . . 0.0 115.05 -175.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -84.06 9.68 11.92 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.944 2.498 . . . . 0.0 115.165 -170.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -145.62 -46.5 0.21 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.397 1.879 . . . . 0.0 110.054 -168.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.1 mt -74.59 161.83 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.131 1.772 . . . . 0.0 109.289 175.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.72 -9.52 0.18 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 117.086 2.254 . . . . 0.0 117.086 177.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 36.8 mtm -93.12 -32.24 14.51 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -175.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -100.61 -10.79 20.61 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.255 1.022 . . . . 0.0 113.631 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 CA--C 1.552 1.035 0 C-N-CA 126.092 1.757 . . . . 0.0 113.185 -171.086 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.0 mp . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.4 t -82.01 -73.06 0.41 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.914 0.886 . . . . 0.0 111.899 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -162.87 -36.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.053 0.541 . . . . 0.0 112.306 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -75.25 -33.4 61.29 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.733 0.413 . . . . 0.0 111.466 171.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -69.35 -42.12 75.71 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.427 -0.795 . . . . 0.0 112.264 -171.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 ptpt -70.44 -25.58 63.26 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.2 -0.938 . . . . 0.0 113.068 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -71.89 2.48 5.46 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 166.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.9 mt -110.78 -43.22 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.572 1.549 . . . . 0.0 110.895 168.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.8 t -79.8 -63.89 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 119.176 0.898 . . . . 0.0 112.447 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.06 -28.44 68.2 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.329 -0.857 . . . . 0.0 112.456 -175.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.71 -17.39 64.07 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 168.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -34.21 17.67 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.636 1.174 . . . . 0.0 111.093 170.352 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.5 mm -61.69 -21.76 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 120.537 -1.352 . . . . 0.0 112.451 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.4 p -90.3 -4.83 56.88 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 171.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -93.54 -56.81 2.79 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.993 1.269 . . . . 0.0 112.517 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.0 m -117.61 -37.85 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -166.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.45 -90.77 0.13 Allowed Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.08 1.324 . . . . 0.0 112.057 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.4 tp -167.35 -47.75 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.566 1.547 . . . . 0.0 111.52 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -96.03 19.36 11.74 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.626 1.57 . . . . 0.0 113.163 -168.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -149.54 -5.02 0.38 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.808 2.043 . . . . 0.0 113.268 -159.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.91 161.66 24.26 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.086 1.354 . . . . 0.0 112.396 172.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -98.62 113.99 26.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.376 0.608 . . . . 0.0 111.327 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.64 -23.23 65.92 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.379 1.472 . . . . 0.0 113.737 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.7 m -65.74 -38.23 88.55 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.132 0.973 . . . . 0.0 112.104 174.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -69.48 -35.18 75.33 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 120.599 -1.313 . . . . 0.0 112.146 177.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.57 -54.62 43.23 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.404 0.682 . . . . 0.0 110.82 167.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.7 p -66.58 -28.43 68.51 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -61.2 -52.31 65.35 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.93 1.692 . . . . 0.0 112.473 170.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.4 mtp-105 -87.1 -35.82 18.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -172.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.72 -18.85 46.5 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.464 1.506 . . . . 0.0 111.402 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.75 65.21 0.84 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.303 1.841 . . . . 0.0 112.008 177.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.1 pt -131.24 174.01 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 127.175 2.19 . . . . 0.0 110.566 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.0 m -69.38 139.11 54.13 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.083 1.353 . . . . 0.0 109.247 165.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.2 t -57.36 -39.14 66.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.301 0.64 . . . . 0.0 111.575 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -68.53 -27.94 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.442 0.905 . . . . 0.0 113.442 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.03 -35.14 76.28 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 111.286 173.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.07 64.07 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.854 0.752 . . . . 0.0 110.469 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.23 -37.32 69.55 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.528 1.131 . . . . 0.0 112.934 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.9 t -86.87 -35.96 18.72 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -63.35 -35.42 80.33 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.041 -1.037 . . . . 0.0 112.916 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mt -48.02 -44.37 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.99 1.316 . . . . 0.0 111.442 173.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -86.42 -34.86 20.02 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 . . . . . 0 CA--C 1.543 0.702 0 CA-C-N 118.299 0.5 . . . . 0.0 112.082 -178.348 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.0 p . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 62.24 38.54 13.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 125.488 1.515 . . . . 0.0 113.18 -171.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -93.08 -2.78 55.19 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 175.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -72.46 16.25 0.15 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.407 1.883 . . . . 0.0 115.291 -175.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.0 pttp -83.84 -6.08 59.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.004 2.122 . . . . 0.0 113.655 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 61.9 m -138.24 -47.79 0.53 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.949 2.099 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.0 mt -76.83 156.0 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.776 1.23 . . . . 0.0 109.684 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 67.82 -4.43 0.98 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 127.415 2.286 . . . . 0.0 116.698 178.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 34.5 mtm -85.99 -49.08 8.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.704 1.138 . . . . 0.0 112.359 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -88.05 -19.29 27.31 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.574 1.15 . . . . 0.0 113.287 -174.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 126.18 1.792 . . . . 0.0 113.321 -172.283 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 mp . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 120.967 0.413 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -92.3 -81.94 0.33 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.998 1.319 . . . . 0.0 111.552 173.078 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -159.07 -29.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.66 -170.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -82.4 -31.63 29.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.204 0.602 . . . . 0.0 111.5 170.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.86 -41.66 82.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.232 -0.918 . . . . 0.0 112.288 -175.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -69.46 -26.4 64.56 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.882 -1.136 . . . . 0.0 113.116 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -69.03 -3.6 13.71 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 166.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.1 mt -100.88 -54.56 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.788 1.235 . . . . 0.0 109.82 164.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.71 -56.7 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 119.398 0.999 . . . . 0.0 112.797 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.08 -30.45 70.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.577 -0.702 . . . . 0.0 111.338 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.55 -46.1 91.45 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 167.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -36.49 82.74 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.519 1.054 . . . . 0.0 111.826 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -24.81 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 O-C-N 120.7 -1.25 . . . . 0.0 112.009 172.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -79.9 -16.2 55.82 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 171.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.96 -50.89 5.11 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.695 -1.253 . . . . 0.0 112.002 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.7 m -124.49 -12.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -167.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 122.62 -74.82 0.37 Allowed Glycine 0 N--CA 1.468 0.831 0 C-N-CA 125.546 1.546 . . . . 0.0 112.602 164.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.5 tp -166.84 -41.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.332 1.453 . . . . 0.0 112.244 175.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.0 m-80 -108.81 -6.25 15.91 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -166.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -93.74 -19.45 21.06 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.156 0.982 . . . . 0.0 113.09 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -65.93 162.48 19.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.861 1.264 . . . . 0.0 112.21 166.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -112.23 167.1 10.69 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.541 1.162 . . . . 0.0 111.876 172.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.54 -21.55 35.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.656 1.182 . . . . 0.0 112.81 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.4 m -63.88 -48.68 75.71 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.489 1.516 . . . . 0.0 111.394 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -65.12 -43.04 93.27 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.088 -1.007 . . . . 0.0 111.956 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -56.96 -54.53 45.65 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.784 0.834 . . . . 0.0 112.067 171.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -63.61 -21.83 66.57 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt -79.21 -44.8 21.12 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.837 1.255 . . . . 0.0 112.094 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -80.34 -36.55 34.02 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.65 1.18 . . . . 0.0 113.401 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 mt -87.64 -20.83 25.79 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.385 1.474 . . . . 0.0 113.167 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.85 61.25 1.96 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.27 1.428 . . . . 0.0 111.94 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -123.56 169.31 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 127.052 2.141 . . . . 0.0 110.557 174.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -65.57 138.53 58.1 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.832 1.253 . . . . 0.0 109.605 164.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 13.3 t -57.54 -38.06 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 123.407 0.683 . . . . 0.0 111.496 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -72.05 -25.93 61.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.82 -36.53 75.68 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.568 -0.729 . . . . 0.0 110.676 169.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.13 71.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.852 0.751 . . . . 0.0 110.904 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -53.59 -41.01 66.14 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.292 1.437 . . . . 0.0 112.705 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -87.63 -33.34 18.86 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -63.29 -36.16 82.74 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.809 -1.182 . . . . 0.0 112.68 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.85 -45.38 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.847 1.259 . . . . 0.0 111.448 174.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -90.74 -27.7 18.76 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 . . . . . 0 CA--C 1.543 0.704 0 CA-C-N 120.158 1.345 . . . . 0.0 112.805 176.898 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.8 p . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 122.74 1.257 . . . . 0.0 114.349 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.45 -13.82 61.95 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.756 2.022 . . . . 0.0 112.496 -173.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -60.35 -19.9 57.37 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.764 2.826 . . . . 0.0 112.874 174.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.79 18.93 0.15 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.294 1.837 . . . . 0.0 115.443 -176.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -81.78 -4.35 56.15 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -142.87 -49.09 0.34 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.108 1.763 . . . . 0.0 110.256 -167.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.9 pt -70.89 161.15 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.694 1.198 . . . . 0.0 112.22 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.29 -9.02 0.13 Allowed 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 127.202 2.201 . . . . 0.0 116.389 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 39.6 mtm -89.04 -36.44 15.79 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.871 1.214 . . . . 0.0 113.462 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -86.83 -19.11 29.44 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 124.581 1.153 . . . . 0.0 111.512 176.611 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -116.37 -72.54 0.69 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.439 1.896 . . . . 0.0 111.84 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.84 -45.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.975 0.51 . . . . 0.0 111.158 -172.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -63.48 -30.65 71.74 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.467 0.707 . . . . 0.0 110.941 174.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -69.14 -35.4 76.32 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 111.842 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -70.54 -35.66 73.26 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.394 -0.816 . . . . 0.0 112.167 170.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -62.61 -7.43 4.74 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 170.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.3 mt -102.98 -55.43 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 125.581 1.552 . . . . 0.0 110.609 170.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 39.3 t -83.9 -55.2 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -172.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.02 -30.04 70.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.874 0.761 . . . . 0.0 112.189 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.17 -38.36 79.59 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.216 0.606 . . . . 0.0 112.431 167.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.82 -36.82 78.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.263 1.025 . . . . 0.0 111.694 173.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.79 -26.66 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 120.851 -1.156 . . . . 0.0 111.555 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -81.0 -8.73 59.84 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 171.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -98.78 -57.84 2.09 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.477 1.489 . . . . 0.0 112.33 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.6 m -118.0 -18.32 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 -164.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.98 -92.27 0.27 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.73 1.634 . . . . 0.0 110.468 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -166.82 -29.41 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.197 1.799 . . . . 0.0 112.976 173.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -99.36 -14.58 19.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.399 1.48 . . . . 0.0 114.133 -176.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -93.87 -14.99 25.47 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.216 1.006 . . . . 0.0 113.413 -175.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.85 166.29 21.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.639 1.576 . . . . 0.0 114.0 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -108.88 115.63 30.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.621 1.169 . . . . 0.0 111.189 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.36 63.27 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.002 1.321 . . . . 0.0 113.775 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.9 m -65.89 -40.01 91.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.102 0.961 . . . . 0.0 111.939 175.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -66.33 -37.41 85.31 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.437 -1.414 . . . . 0.0 112.244 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.68 -50.12 73.78 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.169 0.587 . . . . 0.0 110.817 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.6 p -69.9 -29.66 66.9 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -66.19 -36.59 83.49 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.321 1.449 . . . . 0.0 112.974 173.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.4 mmt-85 -92.83 -39.29 11.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.672 1.189 . . . . 0.0 113.535 -176.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 tt -80.82 -20.2 42.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.628 1.171 . . . . 0.0 111.976 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.24 65.79 0.49 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.67 1.988 . . . . 0.0 112.403 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.6 pt -132.65 -178.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 128.118 2.567 . . . . 0.0 109.295 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -81.53 156.13 25.41 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.361 -0.837 . . . . 0.0 111.052 165.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -58.51 -39.37 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.163 0.985 . . . . 0.0 111.241 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -69.76 -26.47 64.32 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.83 -40.42 87.98 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.701 0.682 . . . . 0.0 111.186 168.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.82 -48.68 65.56 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.349 0.522 . . . . 0.0 109.903 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -53.57 -39.06 64.48 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.433 1.493 . . . . 0.0 112.707 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -84.65 -41.77 16.0 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.851 0.75 . . . . 0.0 112.509 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.59 -35.98 77.44 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.14 -0.975 . . . . 0.0 113.129 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.2 mt -47.62 -51.65 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.297 1.439 . . . . 0.0 111.342 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -85.35 -33.46 22.04 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -176.522 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.481 1.081 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 57.11 5.61 0.27 Allowed 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 -174.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -3.06 50.75 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 119.749 -1.844 . . . . 0.0 114.186 -170.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -70.06 12.76 0.19 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.934 2.094 . . . . 0.0 115.077 -176.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -86.04 -15.42 41.38 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.873 1.669 . . . . 0.0 113.883 -173.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.5 m -123.37 -42.88 2.21 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.167 1.787 . . . . 0.0 110.857 -171.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -72.33 166.61 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 124.612 1.165 . . . . 0.0 108.783 167.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? 67.58 -8.31 0.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.996 2.119 . . . . 0.0 116.138 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.26 -10.4 8.96 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -114.9 -14.91 11.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -161.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.477 0.903 0 C-N-CA 124.963 1.305 . . . . 0.0 114.116 179.411 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -105.21 -70.82 0.76 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 110.995 168.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -163.82 -43.34 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.715 0.806 . . . . 0.0 110.715 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.8 10.82 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.278 1.431 . . . . 0.0 112.799 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -111.89 -46.95 3.18 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.793 1.237 . . . . 0.0 112.482 175.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -67.44 -25.67 66.02 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.746 -1.221 . . . . 0.0 112.641 175.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -65.88 -10.63 40.16 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.491 1.517 . . . . 0.0 113.713 168.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.43 -57.01 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 125.158 1.383 . . . . 0.0 110.226 165.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.2 t -71.27 -49.45 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.064 1.302 . . . . 0.0 112.955 -168.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.1 87.33 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.757 0.708 . . . . 0.0 110.98 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.89 -38.54 82.56 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.21 -34.57 63.76 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.928 0.891 . . . . 0.0 112.346 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.99 -36.04 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.227 -0.921 . . . . 0.0 111.239 170.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.9 m -73.42 -13.41 61.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 172.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -100.8 -40.41 7.33 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.767 1.167 . . . . 0.0 112.323 -172.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.8 m -134.62 -22.47 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -175.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 93.71 135.62 7.66 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 119.619 1.099 . . . . 0.0 111.772 -172.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.15 -25.02 1.3 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 128.167 2.587 . . . . 0.0 114.869 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -89.05 -14.86 35.42 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.158 1.383 . . . . 0.0 113.66 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -114.66 -21.53 10.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.863 1.265 . . . . 0.0 113.47 -172.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.2 169.99 11.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.626 1.171 . . . . 0.0 112.738 171.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p30 -113.25 168.95 9.3 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.036 0.922 . . . . 0.0 111.387 169.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.03 -23.45 35.9 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.217 1.007 . . . . 0.0 112.702 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 m -61.53 -44.62 96.72 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.941 1.696 . . . . 0.0 112.254 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -65.7 -34.04 77.28 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.652 -1.28 . . . . 0.0 112.763 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.54 -51.43 50.89 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.514 0.597 . . . . 0.0 111.483 172.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.4 p -61.98 -18.15 59.44 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -84.19 -32.28 24.66 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.82 1.248 . . . . 0.0 112.826 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -102.69 -36.08 8.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.016 1.326 . . . . 0.0 113.205 -175.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.16 -16.2 41.2 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.679 1.192 . . . . 0.0 113.197 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.25 47.63 13.87 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-O 122.78 1.276 . . . . 0.0 111.628 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.7 pt -110.82 160.0 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 127.969 2.507 . . . . 0.0 109.795 175.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.2 t -68.25 152.04 46.05 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.496 -0.753 . . . . 0.0 110.809 167.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.8 t -58.09 -36.67 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.001 0.92 . . . . 0.0 111.287 -176.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -69.53 -32.25 70.96 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -67.91 -38.87 83.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.787 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.27 -48.79 71.97 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.628 0.649 . . . . 0.0 110.471 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -54.57 -42.34 70.89 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.469 1.507 . . . . 0.0 112.746 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -87.43 -33.37 19.1 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -64.39 -37.33 87.12 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.802 0.841 . . . . 0.0 112.395 177.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.2 mt -48.03 -50.68 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.49 1.116 . . . . 0.0 111.02 174.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -84.64 -30.31 25.0 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 . . . . . 0 CA--C 1.543 0.68 0 CA-C-N 119.769 1.168 . . . . 0.0 113.391 179.907 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.482 1.135 0 CA-C-O 121.934 0.873 . . . . 0.0 112.825 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 54.8 31.19 15.08 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.788 2.035 . . . . 0.0 113.955 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -90.65 -10.82 41.8 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -175.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -76.01 9.83 2.23 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.186 1.794 . . . . 0.0 115.611 -162.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -11.05 58.77 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.421 1.888 . . . . 0.0 114.461 -177.28 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 89.5 m -138.15 -41.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.59 1.556 . . . . 0.0 111.012 -162.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.7 pt -68.03 171.57 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.786 0.834 . . . . 0.0 111.349 171.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? 66.76 -20.18 0.11 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 127.033 2.133 . . . . 0.0 116.054 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 -9.71 11.18 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -111.7 -28.81 7.95 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 -166.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 . . . . . 0 CA--C 1.543 0.676 0 C-N-CA 124.492 1.117 . . . . 0.0 112.315 177.852 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.535 0.366 0 CA-C-O 121.502 0.668 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -119.24 -68.12 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.428 1.891 . . . . 0.0 112.415 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -164.56 -39.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -173.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -67.84 -29.94 69.2 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.437 0.695 . . . . 0.0 110.714 171.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -75.2 -35.49 61.5 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.153 0.981 . . . . 0.0 111.909 -173.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -66.58 -36.64 83.11 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.244 -0.91 . . . . 0.0 112.874 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.49 -4.68 2.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 170.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mt -109.78 -52.6 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 125.415 1.486 . . . . 0.0 110.816 168.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.5 t -68.06 -63.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.738 0.815 . . . . 0.0 111.563 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.88 69.39 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.098 0.559 . . . . 0.0 111.583 -175.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -58.03 -37.23 73.95 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.62 -35.52 62.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.884 1.274 . . . . 0.0 111.789 173.228 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.17 -34.54 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.069 -1.644 . . . . 0.0 110.566 173.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -78.7 -1.97 37.04 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 169.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -101.28 -45.5 5.32 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 120.013 1.279 . . . . 0.0 112.55 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.95 -12.37 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.4 -78.51 0.36 Allowed Glycine 0 N--CA 1.469 0.845 0 C-N-CA 125.161 1.363 . . . . 0.0 111.971 166.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.5 tt -161.19 -48.92 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.762 1.225 . . . . 0.0 112.066 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -95.71 -17.93 20.88 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.202 1.801 . . . . 0.0 114.391 -171.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -85.73 -14.29 45.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -167.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 170.77 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.656 1.583 . . . . 0.0 112.761 168.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -124.42 166.22 16.36 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.558 1.17 . . . . 0.0 112.659 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.54 -28.62 56.37 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.134 1.374 . . . . 0.0 112.551 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -64.44 -46.05 84.86 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.388 1.475 . . . . 0.0 112.039 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -61.44 -50.87 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.628 0.771 . . . . 0.0 111.597 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.0 mt -54.51 -42.32 70.68 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.563 -0.711 . . . . 0.0 111.63 176.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 m -60.84 -28.65 68.99 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.209 1.403 . . . . 0.0 113.876 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -85.92 -31.44 22.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.237 1.415 . . . . 0.0 112.588 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -96.68 -33.54 11.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.448 1.099 . . . . 0.0 113.009 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.9 mt -89.8 -17.1 28.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.925 1.29 . . . . 0.0 113.479 175.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.54 54.33 3.08 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 122.843 1.306 . . . . 0.0 112.684 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.2 pt -119.26 164.96 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 126.923 2.089 . . . . 0.0 110.379 175.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.42 HG23 ' H ' ' A' ' 70' ' ' LYS . 8.9 t -74.28 147.99 41.84 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 121.796 -0.565 . . . . 0.0 110.866 166.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.3 t -54.49 -30.66 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.134 1.374 . . . . 0.0 111.08 176.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.55 -27.04 61.13 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.42 ' H ' HG23 ' A' ' 67' ' ' THR . 4.1 mtmp? -81.33 -32.71 32.89 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.361 0.982 . . . . 0.0 111.15 167.147 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.42 74.51 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.969 0.804 . . . . 0.0 111.462 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -68.16 -25.96 65.52 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -94.4 -33.39 13.17 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -57.56 -44.22 85.11 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.214 -0.929 . . . . 0.0 111.852 175.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.8 mt -47.3 -60.72 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.989 1.316 . . . . 0.0 110.631 176.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -77.21 -18.65 57.55 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -175.027 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 . . . . . 0 N--CA 1.471 0.621 0 CA-C-N 119.583 1.083 . . . . 0.0 112.648 174.929 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.7 p . . . . . 0 N--CA 1.482 1.156 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.9 m120 60.94 16.65 7.13 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -76.76 -8.71 57.81 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.643 -1.286 . . . . 0.0 114.196 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -70.38 13.45 0.17 Allowed 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 125.815 1.646 . . . . 0.0 114.262 176.033 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -85.67 -12.54 51.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.601 2.36 . . . . 0.0 112.878 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 36.3 m -130.42 -42.6 1.18 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.204 1.802 . . . . 0.0 111.269 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.2 mt -71.46 156.45 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.312 1.045 . . . . 0.0 108.34 166.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 65.01 -6.1 0.36 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 117.368 2.358 . . . . 0.0 117.368 171.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -83.6 -28.91 28.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.486 1.039 . . . . 0.0 113.391 175.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -108.62 -14.87 14.54 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.901 1.281 . . . . 0.0 113.43 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 . . . . . 0 CA--C 1.542 0.667 0 C-N-CA 126.239 1.815 . . . . 0.0 112.501 -174.476 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.719 0 CA-C-O 122.163 0.982 . . . . 0.0 113.218 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.1 m -147.58 90.17 1.83 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.163 2.185 . . . . 0.0 111.322 -171.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.84 5.74 3.59 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 161.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -128.49 -38.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.719 1.207 . . . . 0.0 111.05 172.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -74.74 -32.95 62.26 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.149 1.38 . . . . 0.0 111.942 -173.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -67.9 -36.41 80.16 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.299 -0.875 . . . . 0.0 112.241 171.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -63.29 -4.98 2.92 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 170.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.2 mt -109.54 -15.8 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.052 1.741 . . . . 0.0 112.563 174.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.0 t -128.78 -55.86 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 119.316 0.962 . . . . 0.0 112.904 -172.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.73 -40.67 95.9 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.643 1.11 . . . . 0.0 111.124 173.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -66.49 -27.53 67.86 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 172.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.11 -38.48 56.86 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.303 1.041 . . . . 0.0 111.682 175.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.64 -34.28 54.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.826 -1.171 . . . . 0.0 110.642 169.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -72.44 -10.84 60.29 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -106.78 -42.35 4.97 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.423 1.465 . . . . 0.0 112.894 -173.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -127.18 -14.88 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -173.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.07 -79.67 0.35 Allowed Glycine 0 N--CA 1.468 0.768 0 C-N-CA 125.373 1.463 . . . . 0.0 112.044 165.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tt -164.05 -46.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.945 1.298 . . . . 0.0 112.042 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -98.79 -17.2 18.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.316 1.846 . . . . 0.0 114.531 -172.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -87.15 -14.5 41.07 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -68.78 165.98 18.51 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.342 1.457 . . . . 0.0 112.085 166.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -119.81 169.62 9.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.284 1.04 . . . . 0.0 111.831 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.66 -23.18 42.68 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.388 1.075 . . . . 0.0 112.824 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.3 m -67.41 -46.25 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.827 1.651 . . . . 0.0 112.15 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.16 -29.87 69.68 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 120.453 -1.405 . . . . 0.0 112.829 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.83 -54.56 18.1 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.429 1.091 . . . . 0.0 112.031 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.3 p -60.63 -30.17 69.7 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.732 0.813 . . . . 0.0 112.989 -177.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -69.34 -45.12 70.2 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.374 1.47 . . . . 0.0 113.388 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 75.8 mtt85 -95.6 -36.74 11.14 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.23 -15.65 46.09 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.431 1.493 . . . . 0.0 111.18 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.99 60.2 2.2 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.229 1.812 . . . . 0.0 112.155 175.15 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.0 pt -128.88 162.15 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 128.209 2.603 . . . . 0.0 109.408 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.418 HG23 ' H ' ' A' ' 70' ' ' LYS . 12.8 t -68.29 151.5 46.82 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.499 -0.75 . . . . 0.0 110.666 167.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -58.7 -36.03 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.84 0.856 . . . . 0.0 111.007 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.43 -32.59 73.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 177.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.418 ' H ' HG23 ' A' ' 67' ' ' THR . 58.6 mttt -66.4 -37.52 85.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.6 -0.714 . . . . 0.0 111.064 170.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.83 62.19 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.791 0.723 . . . . 0.0 110.28 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -56.52 -35.28 67.9 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.845 1.658 . . . . 0.0 113.403 178.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -86.95 -43.03 12.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.933 0.788 . . . . 0.0 112.634 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.43 -37.58 78.45 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.735 1.152 . . . . 0.0 113.142 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -47.49 -57.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.544 1.137 . . . . 0.0 110.882 173.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.2 pttm -78.88 -35.13 44.15 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 . . . . . 0 CA--C 1.543 0.69 0 CA-C-N 119.149 0.886 . . . . 0.0 112.739 -178.157 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 55.98 9.93 0.52 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.71 2.004 . . . . 0.0 115.728 -172.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.36 10.05 37.68 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.316 1.446 . . . . 0.0 114.246 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.6 p90 -68.75 18.18 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 127.036 2.134 . . . . 0.0 114.717 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -76.97 -25.96 53.39 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.32 2.248 . . . . 0.0 111.474 -177.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 86.1 m -131.11 -42.98 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.892 2.077 . . . . 0.0 111.367 -169.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 mt -76.22 159.21 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.54 1.136 . . . . 0.0 108.859 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 66.93 -22.81 0.11 Allowed 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 127.559 2.344 . . . . 0.0 116.227 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -23.48 26.52 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.798 1.181 . . . . 0.0 114.079 -168.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -107.87 -11.09 15.42 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -171.246 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--O 1.233 0.23 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -129.17 -69.12 0.71 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.934 0.893 . . . . 0.0 112.551 -176.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -156.35 -20.35 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -166.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -93.04 -31.79 14.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.328 0.651 . . . . 0.0 111.465 168.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -79.25 -43.34 23.94 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.804 . . . . 0.0 112.626 -166.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -69.64 -23.47 63.49 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.26 -0.9 . . . . 0.0 112.533 174.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -68.61 -3.7 12.78 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 164.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -106.01 -50.37 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.173 1.389 . . . . 0.0 109.856 165.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 47.5 t -66.69 -62.2 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.417 1.008 . . . . 0.0 111.558 -174.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.75 64.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.907 -0.496 . . . . 0.0 111.944 -175.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -57.15 -39.57 75.49 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 167.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.68 -34.39 64.87 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.221 1.008 . . . . 0.0 112.075 175.436 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -62.52 -34.26 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 O-C-N 120.656 -1.278 . . . . 0.0 110.081 173.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.4 t -75.32 -10.33 59.37 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 170.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -99.22 -43.9 6.45 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.342 -1.474 . . . . 0.0 112.534 -173.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.4 m -132.51 -11.81 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -171.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.02 -77.73 0.39 Allowed Glycine 0 N--CA 1.471 0.993 0 C-N-CA 125.031 1.3 . . . . 0.0 112.478 165.29 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 tp -161.88 -44.0 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.763 1.225 . . . . 0.0 112.159 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -109.6 -8.35 14.99 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.299 1.439 . . . . 0.0 114.25 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -89.08 -14.24 36.78 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 112.838 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.36 166.35 18.8 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.065 1.346 . . . . 0.0 112.339 167.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -124.04 165.5 17.37 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.585 1.183 . . . . 0.0 112.33 173.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.55 60.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.592 1.157 . . . . 0.0 112.932 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -65.11 -44.96 87.05 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.454 1.501 . . . . 0.0 111.942 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.27 -32.0 73.42 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.566 -1.334 . . . . 0.0 112.76 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tp -72.51 -47.89 44.88 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.302 0.641 . . . . 0.0 111.555 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.5 p -63.46 -28.68 70.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.443 1.097 . . . . 0.0 113.077 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.71 -37.3 76.5 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.844 1.258 . . . . 0.0 113.34 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -104.4 -33.21 8.69 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -175.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 tt -84.89 -17.69 37.11 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 176.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.89 69.51 0.67 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.43 1.892 . . . . 0.0 112.373 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -134.45 168.9 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.019 2.127 . . . . 0.0 111.254 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.6 m -69.7 136.92 51.6 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.893 1.277 . . . . 0.0 110.042 166.222 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.2 t -58.09 -35.48 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.169 0.988 . . . . 0.0 111.832 -178.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -69.95 -26.59 64.19 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -78.75 -33.36 46.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.891 169.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -49.47 68.66 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.749 0.704 . . . . 0.0 110.716 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -67.54 -21.04 65.48 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 t -96.33 -35.13 11.32 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.939 0.791 . . . . 0.0 113.047 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -57.72 -43.32 85.2 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.874 0.87 . . . . 0.0 111.935 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.2 mt -46.39 -62.51 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.076 1.35 . . . . 0.0 110.653 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -81.03 5.34 16.76 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 . . . . . 0 CA--C 1.543 0.681 0 C-N-CA 124.275 1.03 . . . . 0.0 112.766 169.757 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.277 0.7 OUTLIER 47.86 25.05 0.67 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.47 1.908 . . . . 0.0 115.324 -170.665 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.65 -3.56 49.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.615 1.166 . . . . 0.0 113.71 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -75.02 18.77 0.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.839 2.056 . . . . 0.0 114.333 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -68.97 -16.76 63.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.543 2.337 . . . . 0.0 114.003 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 t -144.11 -19.26 0.57 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.582 1.553 . . . . 0.0 113.19 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.98 156.54 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 126.029 1.732 . . . . 0.0 108.896 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.3 -0.38 0.67 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -171.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.5 ptm -125.1 -3.04 7.6 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.298 1.439 . . . . 0.0 114.5 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -129.28 -19.68 3.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -163.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 . . . . . 0 CA--C 1.542 0.643 0 C-N-CA 124.829 1.252 . . . . 0.0 112.371 -179.01 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 CA--C 1.535 0.39 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.1 t -140.6 -62.79 0.49 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.769 1.228 . . . . 0.0 114.084 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -161.11 -26.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -165.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -105.11 12.26 32.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.658 1.583 . . . . 0.0 111.351 176.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -118.7 -48.98 2.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.193 0.997 . . . . 0.0 112.354 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -67.24 -22.71 65.68 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.512 -1.367 . . . . 0.0 112.891 171.381 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -66.47 -11.11 50.59 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 169.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.2 mp -95.01 -60.73 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.54 1.536 . . . . 0.0 108.145 169.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.5 t -77.32 -50.77 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.32 65.09 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.563 -0.711 . . . . 0.0 111.924 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -72.97 -35.29 66.87 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.163 1.385 . . . . 0.0 113.313 168.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.35 -36.98 84.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.822 -1.174 . . . . 0.0 111.58 174.293 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.18 -21.62 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 O-C-N 121.103 -0.998 . . . . 0.0 111.596 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.0 m -89.68 -5.32 57.17 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.746 1.219 . . . . 0.0 114.121 169.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -111.62 -33.21 6.42 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.958 1.254 . . . . 0.0 113.243 -173.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -138.11 -14.16 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 114.911 1.448 . . . . 0.0 114.911 -177.219 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.86 -80.82 0.34 Allowed Glycine 0 N--CA 1.469 0.885 0 C-N-CA 125.135 1.35 . . . . 0.0 112.538 167.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 57.3 tp -168.88 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.153 1.781 . . . . 0.0 111.559 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -116.49 -5.07 11.72 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -165.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.4 m-80 -99.41 -18.74 17.33 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 118.603 0.638 . . . . 0.0 112.671 -178.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pp -65.94 158.01 29.21 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.169 1.388 . . . . 0.0 112.227 170.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -113.02 171.17 7.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.338 1.066 . . . . 0.0 111.661 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.29 -19.88 30.88 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.609 1.164 . . . . 0.0 112.798 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -67.59 -45.92 74.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.031 1.732 . . . . 0.0 112.257 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -65.83 -37.91 87.51 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.698 -1.251 . . . . 0.0 111.983 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.56 -52.93 62.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.69 0.796 . . . . 0.0 111.981 172.042 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.5 p -62.83 -22.69 66.83 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.044 0.938 . . . . 0.0 113.193 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.8 mttm -77.84 -42.53 33.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.631 1.573 . . . . 0.0 112.598 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -86.55 -38.56 17.06 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.167 0.987 . . . . 0.0 113.231 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 53.1 mt -88.51 -17.6 29.96 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.67 1.188 . . . . 0.0 113.186 -175.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.21 33.3 21.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 125.326 1.45 . . . . 0.0 113.168 -178.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.7 pt -89.86 163.94 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.772 2.029 . . . . 0.0 110.46 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.438 HG23 ' H ' ' A' ' 70' ' ' LYS . 11.0 t -72.39 151.7 42.48 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 121.578 -0.702 . . . . 0.0 110.926 165.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.4 t -57.4 -35.15 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 124.584 1.153 . . . . 0.0 111.372 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -71.73 -32.57 67.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.438 ' H ' HG23 ' A' ' 67' ' ' THR . 79.8 mttt -69.15 -36.43 77.41 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.789 169.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.6 70.61 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.199 0.909 . . . . 0.0 110.705 176.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -54.19 -42.06 69.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.017 1.727 . . . . 0.0 113.128 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.1 t -85.17 -39.53 17.75 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -59.53 -37.71 79.08 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.804 -1.185 . . . . 0.0 112.893 178.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.0 mt -48.2 -42.07 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.57 1.148 . . . . 0.0 111.914 174.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -95.19 -39.33 10.15 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.7 m120 . . . . . 0 CA--C 1.543 0.706 0 O-C-N 121.221 -0.925 . . . . 0.0 113.42 -175.719 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.42 27.29 4.79 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.429 1.892 . . . . 0.0 113.757 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.03 -16.41 22.73 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.146 0.978 . . . . 0.0 113.324 -179.295 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -74.38 12.35 0.78 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.655 1.982 . . . . 0.0 115.435 -171.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 6.5 47.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.076 2.151 . . . . 0.0 114.795 -167.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 96.8 m -142.88 -46.59 0.31 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.032 1.733 . . . . 0.0 110.135 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.7 pt -73.87 170.74 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.279 1.432 . . . . 0.0 111.955 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 64.97 -3.79 0.55 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.613 1.965 . . . . 0.0 116.17 176.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 21.6 ptt? -140.23 18.84 2.42 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -144.28 -31.83 0.44 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 . . . . . 0 CA--C 1.546 0.799 0 C-N-CA 125.293 1.437 . . . . 0.0 113.224 175.844 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 121.931 0.872 . . . . 0.0 112.07 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.9 t -99.16 -72.0 0.67 Allowed 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 125.587 1.555 . . . . 0.0 111.652 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -161.41 -46.56 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.949 0.499 . . . . 0.0 110.631 -174.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -56.11 -38.47 70.8 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.997 0.919 . . . . 0.0 110.469 172.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -67.37 -36.7 81.89 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.773 1.229 . . . . 0.0 111.8 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mtmt -69.07 -37.5 78.51 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 121.387 -0.821 . . . . 0.0 112.144 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -65.17 -2.44 2.92 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 170.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.7 mt -103.45 -60.98 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.253 1.421 . . . . 0.0 110.411 161.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.0 t -74.52 -53.58 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 CA-C-N 119.776 1.171 . . . . 0.0 113.128 -168.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.98 -34.3 78.11 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.579 -0.7 . . . . 0.0 110.853 177.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.96 -34.04 75.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 170.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.02 75.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.082 -1.011 . . . . 0.0 111.954 174.448 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.52 -32.17 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.171 -0.956 . . . . 0.0 110.697 172.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.5 m -74.96 -11.64 60.16 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -105.08 -39.45 6.22 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.291 1.405 . . . . 0.0 112.899 -172.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.6 p -129.35 -15.88 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -170.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.81 -85.43 0.23 Allowed Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.726 1.155 . . . . 0.0 111.919 171.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.3 tt -165.88 -41.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.727 1.611 . . . . 0.0 111.142 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -110.32 -6.68 14.94 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.883 1.673 . . . . 0.0 115.305 -169.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -95.89 -14.17 23.36 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 -173.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.88 159.69 24.95 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.349 1.459 . . . . 0.0 114.688 -178.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.7 t-20 -101.0 122.86 44.28 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.961 1.304 . . . . 0.0 111.474 -177.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.98 -21.13 64.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.866 1.266 . . . . 0.0 113.479 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 93.5 m -66.24 -41.33 90.18 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.399 -0.813 . . . . 0.0 111.491 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.91 -43.07 99.61 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.05 -1.031 . . . . 0.0 111.721 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -57.92 -44.56 86.91 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 112.286 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 p -61.86 -27.14 68.57 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.254 -0.904 . . . . 0.0 113.3 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -84.16 -38.5 20.58 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.807 1.643 . . . . 0.0 111.91 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.2 mmt-85 -91.17 -34.67 14.93 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.041 1.336 . . . . 0.0 114.276 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -92.96 -12.69 30.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.364 1.065 . . . . 0.0 112.937 174.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.73 65.33 1.25 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.056 1.343 . . . . 0.0 112.045 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -133.19 163.06 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.601 1.96 . . . . 0.0 111.586 -177.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.5 m -57.43 134.31 55.95 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.912 1.285 . . . . 0.0 109.65 163.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.8 t -59.1 -34.58 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 121.569 -0.707 . . . . 0.0 111.389 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.06 -29.01 64.78 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.249 -0.907 . . . . 0.0 113.363 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.71 -36.36 78.34 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.896 169.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.83 -50.13 65.72 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.08 0.855 . . . . 0.0 110.811 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -54.78 -38.83 67.73 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.195 1.398 . . . . 0.0 112.815 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.4 t -88.15 -34.98 17.67 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 177.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.64 -38.01 83.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.085 -1.009 . . . . 0.0 112.266 177.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.8 mt -48.01 -60.07 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.813 1.245 . . . . 0.0 110.954 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -75.04 -21.9 58.76 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 . . . . . 0 CA--C 1.543 0.706 0 CA-C-N 119.023 0.829 . . . . 0.0 112.83 176.367 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 53.91 21.51 2.85 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 125.698 1.599 . . . . 0.0 114.926 -172.052 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . 0.262 0.0 OUTLIER -101.9 27.6 6.39 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 120.042 -1.661 . . . . 0.0 113.07 -172.167 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -114.63 9.95 16.64 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.51 1.524 . . . . 0.0 113.809 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.0 pttt -93.91 -20.85 19.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.399 1.879 . . . . 0.0 115.041 -158.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 m -154.57 -51.48 0.09 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.335 1.854 . . . . 0.0 110.494 -169.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.7 pt -72.02 -174.66 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 111.382 171.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 65.03 -27.2 0.1 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.499 2.32 . . . . 0.0 116.386 -172.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -87.74 -18.57 29.15 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.943 1.247 . . . . 0.0 114.021 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -116.68 3.62 13.06 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.788 1.235 . . . . 0.0 114.135 178.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 . . . . . 0 N--CA 1.472 0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 112.782 -173.116 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 CA--C 1.535 0.374 0 CA-C-O 122.05 0.928 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.3 p -106.52 -83.05 0.53 Allowed 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.76 2.424 . . . . 0.0 111.688 -178.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -155.48 -48.97 0.08 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 124.664 1.186 . . . . 0.0 110.774 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.36 -28.55 69.36 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.497 0.719 . . . . 0.0 110.958 172.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -68.69 -37.1 79.3 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.231 1.012 . . . . 0.0 111.775 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -69.24 -34.06 74.24 Favored 'General case' 0 N--CA 1.481 1.112 0 O-C-N 120.788 -1.195 . . . . 0.0 112.971 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -63.56 -3.67 2.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 169.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.6 mt -109.01 -49.67 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.674 1.59 . . . . 0.0 110.687 168.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.96 -65.1 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.71 1.141 . . . . 0.0 112.321 -177.902 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.28 73.71 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.668 0.787 . . . . 0.0 111.439 -173.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.7 -43.17 94.18 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 170.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -72.0 -35.78 69.56 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.229 -0.92 . . . . 0.0 112.086 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.63 -29.16 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.916 1.286 . . . . 0.0 111.536 170.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.0 t -77.06 -17.46 58.75 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 173.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -95.55 -50.14 5.09 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.704 -1.247 . . . . 0.0 111.996 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.03 -7.1 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -168.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 116.19 -76.08 0.27 Allowed Glycine 0 N--CA 1.467 0.765 0 C-N-CA 125.476 1.512 . . . . 0.0 112.83 163.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -175.05 -33.85 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 127.031 2.133 . . . . 0.0 111.186 179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -111.72 -6.1 14.37 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.175 1.39 . . . . 0.0 114.536 -165.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -97.32 -21.33 17.29 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.159 0.984 . . . . 0.0 113.236 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.2 pp -68.09 167.05 14.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.53 0.732 . . . . 0.0 112.383 167.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -128.07 170.11 13.3 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.501 1.144 . . . . 0.0 112.28 174.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.94 -32.54 61.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.061 1.344 . . . . 0.0 112.947 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.42 -52.29 64.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.006 1.322 . . . . 0.0 111.149 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.29 -34.28 77.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.066 0.946 . . . . 0.0 112.341 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 tp -66.92 -47.98 70.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.008 0.523 . . . . 0.0 111.361 173.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -60.18 -25.36 65.51 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.853 1.261 . . . . 0.0 113.98 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -82.13 -16.73 48.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.006 1.723 . . . . 0.0 113.434 -177.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -119.85 -42.46 2.61 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.77 1.628 . . . . 0.0 112.137 -175.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tp -76.39 -12.42 60.05 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.371 1.868 . . . . 0.0 112.454 172.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.31 64.56 1.34 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.344 1.858 . . . . 0.0 112.592 170.626 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.8 pt -139.11 174.74 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 127.588 2.355 . . . . 0.0 109.966 -176.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.8 t -75.8 151.59 37.49 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.532 -0.73 . . . . 0.0 110.769 163.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.9 t -60.57 -34.28 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.025 0.93 . . . . 0.0 111.293 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.19 -31.92 72.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -69.23 -35.69 76.42 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.19 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.31 -45.13 73.81 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.02 0.827 . . . . 0.0 110.946 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.78 -39.12 73.5 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.079 1.351 . . . . 0.0 112.813 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -87.3 -40.38 14.54 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.21 -41.65 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.063 -1.023 . . . . 0.0 112.241 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.3 mt -54.68 -36.94 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 124.311 1.044 . . . . 0.0 112.695 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -92.93 -34.6 13.72 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.948 1.249 . . . . 0.0 113.001 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 . . . . . 0 CA--C 1.541 0.635 0 C-N-CA 123.162 0.585 . . . . 0.0 112.536 -170.796 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.8 t . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 122.429 1.109 . . . . 0.0 112.865 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 m120 53.46 20.1 1.91 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.08 2.152 . . . . 0.0 115.894 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -87.72 -4.85 58.89 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.086 1.354 . . . . 0.0 113.85 -175.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -75.93 8.79 2.83 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.484 1.914 . . . . 0.0 115.004 -166.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -85.73 -7.11 58.98 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.918 1.687 . . . . 0.0 114.704 -170.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.5 m -139.39 -43.89 0.45 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.216 1.807 . . . . 0.0 110.315 -165.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 40.1 pt -64.94 172.23 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.832 0.853 . . . . 0.0 111.92 170.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? 66.07 -18.28 0.11 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 127.387 2.275 . . . . 0.0 116.734 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.47 -15.55 8.02 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.402 1.456 . . . . 0.0 114.531 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -104.28 -25.36 12.91 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -165.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? . . . . . 0 CA--C 1.543 0.68 0 C-N-CA 123.7 0.8 . . . . 0.0 112.477 -176.632 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.3 mp . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.6 p -98.01 -71.16 0.7 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.375 1.07 . . . . 0.0 111.869 172.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -159.69 -29.05 0.06 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -170.312 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -85.86 -28.92 24.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.165 0.586 . . . . 0.0 110.684 173.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -78.03 -39.32 42.38 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.242 -0.911 . . . . 0.0 111.257 -167.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -68.34 -29.92 68.76 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.746 0.818 . . . . 0.0 112.566 171.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.11 -7.62 13.11 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -103.29 -56.47 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.956 1.302 . . . . 0.0 109.763 167.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -66.6 -55.84 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.753 1.16 . . . . 0.0 112.198 -173.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.92 78.93 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.739 -0.601 . . . . 0.0 111.253 -176.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -60.03 -42.72 95.0 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 170.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.21 -36.13 76.94 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.309 1.044 . . . . 0.0 112.047 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -58.81 -35.62 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 O-C-N 120.859 -1.151 . . . . 0.0 111.399 174.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.6 m -70.45 -12.3 61.49 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 173.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -91.69 -43.73 9.42 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.14 1.337 . . . . 0.0 112.178 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.1 -10.71 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -165.56 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 125.02 -79.36 0.36 Allowed Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.714 1.149 . . . . 0.0 111.696 170.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -171.23 -43.84 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.559 1.944 . . . . 0.0 111.438 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -106.73 -12.04 15.64 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.996 1.719 . . . . 0.0 114.667 -167.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -90.12 -21.7 22.13 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -175.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.07 164.59 8.2 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.664 1.186 . . . . 0.0 113.224 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.97 164.9 12.87 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.383 1.087 . . . . 0.0 112.139 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.88 -29.38 44.39 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.707 1.203 . . . . 0.0 113.269 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -59.81 -43.58 94.42 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 0.0 111.767 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.92 -25.81 65.66 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.637 -1.29 . . . . 0.0 113.545 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.75 -50.32 17.79 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.978 0.808 . . . . 0.0 111.445 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.3 p -59.94 -26.06 65.67 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -76.24 -26.79 56.37 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 114.074 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 78.8 mtt85 -113.87 -39.35 4.0 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.078 1.351 . . . . 0.0 113.112 -172.093 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 tt -84.08 -19.35 34.45 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.404 1.881 . . . . 0.0 111.112 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 60.32 72.71 0.51 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.706 2.002 . . . . 0.0 112.473 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.8 pt -135.28 164.4 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 127.367 2.267 . . . . 0.0 110.356 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.5 m -62.9 140.35 58.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.739 1.216 . . . . 0.0 109.913 166.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.9 t -57.54 -38.65 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 O-C-N 121.483 -0.76 . . . . 0.0 111.436 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.06 -26.79 60.59 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.447 -0.783 . . . . 0.0 113.102 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.39 -37.54 80.47 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 118.104 -0.95 . . . . 0.0 110.597 167.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.0 -47.51 74.24 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.286 0.948 . . . . 0.0 111.54 176.269 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.74 -43.77 85.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.931 1.292 . . . . 0.0 112.498 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -84.62 -34.34 23.13 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -55.37 -48.36 74.4 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.376 1.07 . . . . 0.0 111.266 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.7 mt -46.13 -59.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.752 1.221 . . . . 0.0 110.472 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -87.5 -3.22 59.0 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -172.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 . . . . . 0 N--CA 1.473 0.719 0 CA-C-N 119.256 0.935 . . . . 0.0 112.66 170.596 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.4 m120 55.44 24.0 6.33 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 116.644 2.09 . . . . 0.0 116.644 168.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -108.77 -0.51 19.92 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.384 1.474 . . . . 0.0 114.038 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -76.28 19.68 0.24 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.847 1.659 . . . . 0.0 114.671 -175.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt -93.51 -2.11 54.78 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 127.103 2.161 . . . . 0.0 114.262 -162.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.1 m -148.33 -46.04 0.15 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.936 2.494 . . . . 0.0 108.763 -170.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.3 pt -73.07 161.2 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 111.424 169.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.6 mptt 61.38 18.79 9.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.526 1.53 . . . . 0.0 114.812 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 38.8 mtt -124.67 -44.96 1.94 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.833 1.253 . . . . 0.0 113.172 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -115.77 27.33 9.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.664 1.586 . . . . 0.0 112.074 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 CA--C 1.541 0.605 0 C-N-CA 126.199 1.8 . . . . 0.0 112.075 -167.489 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.468 0.459 0 CA-C-O 121.325 0.583 . . . . 0.0 111.752 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.4 m -102.71 -72.36 0.69 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.493 1.517 . . . . 0.0 112.227 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -162.47 -44.39 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.176 0.59 . . . . 0.0 111.498 -173.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -61.26 -33.78 74.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.588 0.755 . . . . 0.0 110.916 170.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -68.77 -37.58 79.45 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.626 1.171 . . . . 0.0 111.645 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt -66.32 -35.21 79.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.146 -0.972 . . . . 0.0 112.831 171.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -65.06 -1.33 2.04 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 171.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.6 mt -113.58 -14.39 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 126.354 1.862 . . . . 0.0 112.098 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -124.73 -58.96 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.124 0.97 . . . . 0.0 112.642 -174.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.15 -37.75 86.38 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.423 1.011 . . . . 0.0 111.089 175.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.21 -32.03 73.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.713 0.805 . . . . 0.0 113.049 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -77.51 -38.4 48.97 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.027 0.931 . . . . 0.0 111.871 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.14 -33.05 52.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.7 1.2 . . . . 0.0 110.462 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -71.14 -16.38 62.55 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 171.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -104.79 -42.91 5.24 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.681 -1.262 . . . . 0.0 113.024 -171.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.2 m -127.61 -13.21 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -172.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -82.52 0.31 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 125.056 1.313 . . . . 0.0 112.195 168.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 tt -171.75 -43.86 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 111.342 -178.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -112.26 -4.08 14.44 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.003 1.721 . . . . 0.0 114.932 -168.509 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -93.37 -22.3 19.02 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 112.792 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 pp -66.77 165.72 14.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.946 1.298 . . . . 0.0 112.313 164.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -118.24 172.53 7.38 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.394 1.093 . . . . 0.0 111.599 171.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.0 58.0 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.686 1.194 . . . . 0.0 112.815 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -65.42 -48.06 74.11 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.729 1.611 . . . . 0.0 112.194 -173.739 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -66.47 -29.57 69.72 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.734 -1.229 . . . . 0.0 112.686 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.29 -46.97 25.43 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.326 1.45 . . . . 0.0 110.293 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.6 p -67.89 -29.3 68.37 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.02 1.328 . . . . 0.0 113.469 177.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -66.81 -39.4 87.72 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.866 1.266 . . . . 0.0 112.675 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 83.4 mtt85 -86.99 -42.08 13.4 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.384 1.074 . . . . 0.0 113.28 -179.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 tt -81.26 -18.35 46.27 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.129 1.372 . . . . 0.0 111.829 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 62.67 68.3 0.66 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.604 1.961 . . . . 0.0 112.08 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.1 pt -135.41 177.63 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 127.231 2.213 . . . . 0.0 110.833 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.7 m -73.15 144.4 46.92 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.703 1.601 . . . . 0.0 109.813 166.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.7 t -58.79 -39.89 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 O-C-N 121.442 -0.786 . . . . 0.0 111.434 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -69.63 -30.29 67.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.0 mmtt -64.5 -38.42 90.97 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.161 170.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.61 -48.26 64.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.909 0.777 . . . . 0.0 110.216 175.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -56.34 -42.63 78.04 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.837 1.255 . . . . 0.0 112.891 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 t -82.21 -38.11 25.04 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -61.59 -36.8 81.72 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.861 -1.149 . . . . 0.0 112.937 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.3 mt -49.84 -45.77 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.154 0.981 . . . . 0.0 111.191 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -93.31 -13.0 28.71 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.259 1.578 . . . . 0.0 115.259 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.2 m120 . . . . . 0 N--CA 1.472 0.632 0 CA-C-N 119.843 1.201 . . . . 0.0 112.409 169.175 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 57.3 p . . . . . 0 N--CA 1.478 0.954 0 CA-C-O 122.779 1.276 . . . . 0.0 114.334 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -75.95 -5.28 45.47 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.62 1.568 . . . . 0.0 112.228 -171.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.94 -20.15 66.11 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 128.712 2.805 . . . . 0.0 113.592 173.069 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -66.66 12.56 0.07 Allowed 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.949 2.203 . . . . 0.0 116.949 -172.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -5.58 59.32 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 -169.198 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.7 m -139.0 -47.44 0.48 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.445 1.498 . . . . 0.0 110.806 -167.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 pt -71.12 165.1 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 124.192 0.997 . . . . 0.0 111.828 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? 65.24 -14.45 0.11 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 126.787 2.035 . . . . 0.0 116.417 176.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 49.4 mtm -85.21 -43.55 13.69 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.787 1.176 . . . . 0.0 112.783 -176.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -103.75 -7.6 20.48 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -176.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.545 0.773 0 C-N-CA 124.59 1.156 . . . . 0.0 110.757 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.649 0 CA-C-O 122.677 1.227 . . . . 0.0 113.424 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.5 t -127.72 78.96 1.86 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.041 1.737 . . . . 0.0 111.585 -161.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 59.34 18.73 6.98 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.493 1.917 . . . . 0.0 116.105 166.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -144.58 -38.88 0.28 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.124 1.77 . . . . 0.0 110.916 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -67.03 -47.2 72.14 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.298 -0.876 . . . . 0.0 111.678 -178.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -65.78 -25.77 67.41 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.86 -1.15 . . . . 0.0 113.125 171.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -69.01 -11.04 60.42 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 169.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.0 mt -95.46 -51.49 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.114 1.365 . . . . 0.0 109.82 165.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.48 -60.05 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.569 0.748 . . . . 0.0 111.829 -169.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.0 -28.55 65.6 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.167 0.44 . . . . 0.0 111.659 -176.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.28 -43.44 87.98 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 165.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -38.36 88.97 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.173 0.897 . . . . 0.0 111.836 174.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.1 mm -57.05 -35.02 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 120.473 -1.392 . . . . 0.0 111.076 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -75.61 -8.41 56.7 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.385 1.624 . . . . 0.0 115.385 173.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.51 -53.43 4.06 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.473 1.488 . . . . 0.0 111.956 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.1 m -120.77 -13.93 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 -165.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.41 -75.25 0.43 Allowed Glycine 0 N--CA 1.469 0.854 0 C-N-CA 124.57 1.081 . . . . 0.0 112.998 164.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 51.4 tp -164.94 -43.57 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.656 1.182 . . . . 0.0 112.215 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -112.4 -5.35 14.11 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.944 1.298 . . . . 0.0 114.393 -168.512 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -92.93 -15.1 26.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.125 0.97 . . . . 0.0 113.212 -174.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -68.25 166.42 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 166.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -115.82 167.58 10.81 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 122.48 1.133 . . . . 0.0 111.789 170.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.38 -22.89 38.02 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.402 1.081 . . . . 0.0 112.577 -179.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -66.1 -49.57 67.09 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.777 1.631 . . . . 0.0 111.441 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -64.06 -43.79 94.4 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.049 -1.032 . . . . 0.0 111.917 178.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -55.98 -58.48 7.74 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.642 0.777 . . . . 0.0 111.386 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.7 p -61.36 -21.33 63.94 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -78.81 -43.15 25.93 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.897 1.279 . . . . 0.0 112.345 175.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -79.7 -34.12 40.45 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.945 1.298 . . . . 0.0 113.234 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.8 mt -87.31 -23.8 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.955 1.702 . . . . 0.0 113.548 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.17 49.16 9.54 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.083 1.353 . . . . 0.0 112.262 -174.071 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.9 pt -107.24 172.44 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 126.738 2.015 . . . . 0.0 110.712 169.919 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 m -71.38 137.93 48.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.283 1.433 . . . . 0.0 109.538 165.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -56.28 -38.83 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.778 0.831 . . . . 0.0 111.672 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -72.92 -22.18 60.77 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -75.23 -37.07 61.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.696 166.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.9 -47.81 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.387 0.54 . . . . 0.0 110.813 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -51.46 -37.17 47.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.313 1.845 . . . . 0.0 113.567 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.5 t -96.26 -30.64 13.34 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -63.85 -32.37 73.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.003 -1.061 . . . . 0.0 112.499 174.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 33.2 mt -50.92 -27.11 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.54 1.536 . . . . 0.0 112.791 173.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -115.34 -26.02 7.76 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 176.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 . . . . . 0 CA--C 1.551 1.017 0 C-N-CA 124.906 1.282 . . . . 0.0 112.542 171.259 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.5 p . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 115.531 1.678 . . . . 0.0 115.531 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 50.85 15.01 0.21 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.434 1.893 . . . . 0.0 115.193 -164.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -14.21 58.97 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 120.018 -1.676 . . . . 0.0 113.378 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -73.88 14.94 0.33 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.841 2.056 . . . . 0.0 114.167 176.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -81.43 5.05 18.82 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.835 2.454 . . . . 0.0 114.436 -173.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 51.5 m -144.55 -46.59 0.25 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 127.066 2.146 . . . . 0.0 110.097 -170.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.5 mt -70.72 159.65 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.938 1.295 . . . . 0.0 109.223 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.5 mmtp 67.73 0.85 2.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.655 1.982 . . . . 0.0 116.211 177.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.9 mtm -106.66 -42.63 4.92 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.22 -21.48 31.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.792 0.837 . . . . 0.0 113.117 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 . . . . . 0 CA--C 1.544 0.728 0 C-N-CA 126.246 1.818 . . . . 0.0 110.939 178.21 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 121.471 0.653 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.3 t -113.25 -73.09 0.68 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.268 1.827 . . . . 0.0 112.043 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -161.86 -45.86 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.28 0.632 . . . . 0.0 111.19 -171.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.69 -32.23 73.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.534 0.734 . . . . 0.0 111.124 173.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -67.79 -35.36 78.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.129 0.972 . . . . 0.0 111.601 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -69.69 -35.07 74.76 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.295 -0.878 . . . . 0.0 112.667 171.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.71 -5.98 3.2 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.27 -24.56 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.81 1.644 . . . . 0.0 112.382 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.433 HG22 HD22 ' A' ' 60' ' ' LEU . 51.2 t -112.75 -59.59 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 124.597 1.159 . . . . 0.0 112.598 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.26 -33.11 73.99 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.269 -0.894 . . . . 0.0 111.893 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -68.71 -30.85 69.58 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.182 0.993 . . . . 0.0 113.208 171.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -76.65 -37.85 55.57 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.873 1.269 . . . . 0.0 111.623 177.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.47 -40.0 65.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 O-C-N 121.062 -1.023 . . . . 0.0 110.085 167.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -73.11 -6.22 44.24 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -110.03 -30.96 7.55 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.331 1.423 . . . . 0.0 113.261 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.1 p -135.2 -16.54 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -173.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.96 -83.49 0.28 Allowed Glycine 0 N--CA 1.469 0.886 0 C-N-CA 125.098 1.332 . . . . 0.0 111.683 171.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 tt -166.31 -44.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.082 1.753 . . . . 0.0 110.551 177.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -107.55 -6.73 16.81 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.224 1.81 . . . . 0.0 115.155 -168.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.36 -16.94 24.1 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.911 0.778 . . . . 0.0 112.862 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -63.46 163.76 10.37 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.181 1.392 . . . . 0.0 112.754 167.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -112.69 170.6 8.07 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.233 1.016 . . . . 0.0 111.47 170.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -21.66 31.72 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.424 1.089 . . . . 0.0 112.72 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -65.24 -45.35 85.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.809 1.643 . . . . 0.0 112.219 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -65.46 -36.48 84.0 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.556 -1.34 . . . . 0.0 111.993 176.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.433 HD22 HG22 ' A' ' 43' ' ' VAL . 47.2 mt -65.89 -47.25 75.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.182 0.593 . . . . 0.0 112.146 173.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.8 p -63.9 -31.05 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.11 -0.994 . . . . 0.0 113.036 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -71.47 -43.6 66.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.338 1.455 . . . . 0.0 112.834 176.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -94.78 -37.11 11.41 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -86.28 -15.36 40.95 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.446 1.499 . . . . 0.0 111.568 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 59.82 67.18 0.9 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.244 1.818 . . . . 0.0 112.657 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.1 pt -136.87 161.64 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 128.399 2.68 . . . . 0.0 109.022 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 70' ' ' LYS . 15.3 t -68.4 153.17 44.29 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.364 -0.835 . . . . 0.0 110.751 167.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.99 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.679 0.792 . . . . 0.0 111.126 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.06 -31.5 70.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.407 ' H ' HG23 ' A' ' 67' ' ' THR . 27.7 mttm -64.93 -40.69 95.44 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.62 170.086 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.33 -49.18 65.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.651 0.66 . . . . 0.0 110.64 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -54.35 -42.47 70.29 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.438 1.495 . . . . 0.0 112.483 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -85.15 -38.06 19.47 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.509 0.595 . . . . 0.0 112.526 -178.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -61.74 -35.73 78.93 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.054 -1.029 . . . . 0.0 112.984 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.9 mt -47.69 -55.27 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.194 0.998 . . . . 0.0 110.719 172.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -77.4 -30.32 53.53 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.3 m120 . . . . . 0 N--CA 1.472 0.653 0 CA-C-N 120.098 1.317 . . . . 0.0 112.268 175.96 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 44.75 36.73 1.93 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.095 1.758 . . . . 0.0 114.707 -168.322 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.27 -5.65 24.03 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.329 . . . . 0.0 113.851 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -71.63 17.25 0.09 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.634 1.974 . . . . 0.0 114.082 174.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.9 pttt -84.46 -10.4 57.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 128.056 2.542 . . . . 0.0 113.116 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 85.4 m -137.03 -42.7 0.57 Allowed 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.558 1.943 . . . . 0.0 111.24 -175.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.5 mt -71.19 153.42 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.829 0.852 . . . . 0.0 108.881 167.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm 66.68 -4.66 0.72 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 170.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -82.18 -26.89 32.99 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.939 0.79 . . . . 0.0 113.032 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -114.91 -10.67 12.29 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.063 1.345 . . . . 0.0 113.95 -175.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 . . . . . 0 N--CA 1.472 0.636 0 C-N-CA 125.406 1.482 . . . . 0.0 111.988 -179.834 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.54 0.589 0 CA-C-O 121.809 0.814 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.2 m -134.05 71.36 1.45 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.662 1.985 . . . . 0.0 111.3 -173.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 66.44 8.76 5.97 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 163.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -128.44 -32.6 2.18 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.27 1.028 . . . . 0.0 111.903 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -76.1 -42.71 46.33 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.978 1.311 . . . . 0.0 111.407 -170.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.25 -31.02 72.06 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.179 0.992 . . . . 0.0 112.846 166.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -68.21 -3.48 10.8 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 169.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -103.54 -55.96 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.287 1.435 . . . . 0.0 109.579 166.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.8 t -74.18 -50.69 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 CA-C-N 119.308 0.958 . . . . 0.0 113.075 -170.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.09 -34.72 78.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.88 0.764 . . . . 0.0 111.084 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.05 -35.52 77.15 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 170.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.51 -39.72 70.6 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.182 -0.949 . . . . 0.0 111.521 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -36.82 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 O-C-N 120.601 -1.312 . . . . 0.0 110.944 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.8 m -70.83 -11.49 60.99 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 171.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -104.48 -42.24 5.5 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.318 1.417 . . . . 0.0 112.873 -172.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.9 m -128.81 -13.36 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.49 -79.2 0.34 Allowed Glycine 0 N--CA 1.47 0.923 0 C-N-CA 125.075 1.322 . . . . 0.0 112.504 164.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 tp -159.8 -47.33 0.05 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.371 1.068 . . . . 0.0 112.143 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -106.34 -13.39 15.39 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.684 1.594 . . . . 0.0 114.307 -170.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -87.16 -11.04 51.15 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -171.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.4 pp -69.9 175.1 4.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.166 1.786 . . . . 0.0 113.975 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -117.68 120.85 39.26 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.083 0.953 . . . . 0.0 111.964 -178.044 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.11 -24.91 68.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.289 0.636 . . . . 0.0 112.641 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.0 m -69.38 -43.6 73.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.9 1.28 . . . . 0.0 112.1 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -63.51 -38.51 91.4 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.266 -1.521 . . . . 0.0 111.763 173.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.73 -51.29 69.98 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.775 0.43 . . . . 0.0 111.633 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 98.6 p -65.26 -26.8 68.25 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -74.17 -46.44 42.23 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.608 1.563 . . . . 0.0 112.07 175.403 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.3 mmt-85 -72.8 -42.9 63.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.846 1.258 . . . . 0.0 113.127 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -92.38 -20.34 21.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.102 1.761 . . . . 0.0 112.249 -170.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 62.25 68.17 0.69 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.279 1.832 . . . . 0.0 112.844 -178.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.5 pt -132.35 173.97 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 128.55 2.74 . . . . 0.0 108.527 174.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.423 HG23 ' H ' ' A' ' 70' ' ' LYS . 12.7 t -78.36 152.94 32.04 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 121.126 -0.983 . . . . 0.0 110.573 165.313 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.6 t -57.49 -36.45 53.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.093 0.957 . . . . 0.0 111.134 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.46 -33.8 75.87 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.423 ' H ' HG23 ' A' ' 67' ' ' THR . 43.6 mtmt -69.2 -33.45 73.37 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.049 -0.976 . . . . 0.0 111.396 172.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -49.67 54.26 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.548 1.067 . . . . 0.0 110.679 174.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -55.15 -39.23 69.25 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.439 1.496 . . . . 0.0 112.796 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.6 t -83.88 -41.16 17.73 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -59.93 -34.32 73.08 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 120.862 -1.149 . . . . 0.0 112.835 -179.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.09 -64.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.657 1.183 . . . . 0.0 110.408 171.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.71 -21.98 60.96 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -179.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 CA--C 1.541 0.613 0 CA-C-N 119.081 0.855 . . . . 0.0 112.725 -178.934 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.3 p . . . . . 0 N--CA 1.483 1.185 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 48.94 25.98 1.21 Allowed 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 125.83 1.652 . . . . 0.0 114.77 -166.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.52 -8.81 28.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.493 1.517 . . . . 0.0 113.805 -178.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -70.9 15.36 0.11 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.367 2.267 . . . . 0.0 115.569 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -77.39 1.87 17.69 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 126.703 2.001 . . . . 0.0 114.756 -172.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.4 m -147.6 -48.89 0.17 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.707 2.003 . . . . 0.0 110.297 -170.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.7 mt -71.31 156.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.649 1.18 . . . . 0.0 109.533 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? 68.23 -4.92 0.97 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.991 2.116 . . . . 0.0 116.118 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.7 mtm -102.99 -43.09 5.61 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -94.11 -9.07 37.74 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 . . . . . 0 CA--C 1.541 0.625 0 C-N-CA 125.325 1.45 . . . . 0.0 112.222 -175.893 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 CA--C 1.535 0.37 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.5 m -120.46 -66.76 1.03 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.802 1.641 . . . . 0.0 112.162 177.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -163.6 -48.91 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.0 110.453 -170.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.61 72.89 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.937 177.514 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -68.92 -34.42 75.36 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.185 0.994 . . . . 0.0 111.921 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -69.63 -33.62 72.9 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.88 -1.138 . . . . 0.0 111.847 171.871 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -67.09 -1.16 3.9 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 170.572 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.1 mt -112.53 -26.86 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.523 1.929 . . . . 0.0 112.44 171.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.2 t -107.95 -59.91 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.749 1.159 . . . . 0.0 112.378 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.37 93.81 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.767 0.827 . . . . 0.0 111.701 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -66.47 -38.44 87.33 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -71.38 -32.05 68.01 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.619 1.168 . . . . 0.0 112.677 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.56 -31.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.08 0.952 . . . . 0.0 111.768 167.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 t -74.71 -17.16 60.7 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.479 0.712 . . . . 0.0 112.86 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -90.61 -44.21 9.68 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.223 -0.923 . . . . 0.0 111.318 176.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 84.9 t -108.12 -48.85 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -167.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.34 -79.84 0.18 Allowed Glycine 0 N--CA 1.469 0.894 0 CA-C-N 118.182 0.446 . . . . 0.0 114.053 170.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 tt -172.63 -39.3 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.805 1.642 . . . . 0.0 113.331 -173.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -121.62 -9.69 8.89 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.616 1.567 . . . . 0.0 114.984 -168.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -3.29 28.09 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -172.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.38 157.43 37.06 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.59 1.956 . . . . 0.0 113.961 -170.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -85.38 104.93 15.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.214 1.006 . . . . 0.0 109.726 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.78 -24.39 61.72 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.347 0.659 . . . . 0.0 112.349 171.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -58.67 -46.03 88.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.426 1.89 . . . . 0.0 112.405 169.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -63.63 -37.64 88.11 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.307 -1.495 . . . . 0.0 112.423 175.57 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.19 -49.82 70.53 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.566 0.621 . . . . 0.0 112.174 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.1 p -64.53 -22.96 67.11 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.235 -0.916 . . . . 0.0 113.468 -179.607 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -81.76 -14.47 56.41 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.608 1.563 . . . . 0.0 113.751 175.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -119.99 -42.18 2.61 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.227 1.411 . . . . 0.0 113.582 -172.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.1 mp -85.85 -12.01 51.88 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.868 1.267 . . . . 0.0 112.603 172.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.67 63.97 1.55 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.313 1.445 . . . . 0.0 111.905 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -128.22 167.19 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 126.937 2.095 . . . . 0.0 111.45 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.8 m -63.86 141.46 58.76 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.72 1.208 . . . . 0.0 109.721 167.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.74 -36.94 68.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.251 -0.905 . . . . 0.0 111.437 -178.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -72.83 -28.71 62.71 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 177.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -66.05 -40.07 90.63 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.524 -0.75 . . . . 0.0 110.519 168.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.75 -47.82 73.95 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.91 0.777 . . . . 0.0 111.14 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.51 -38.69 69.53 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.451 1.5 . . . . 0.0 112.942 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -88.76 -34.95 16.94 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.96 -34.91 79.05 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.73 1.212 . . . . 0.0 112.884 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.6 mt -50.29 -36.36 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.735 1.214 . . . . 0.0 112.096 173.344 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -92.01 -43.95 9.14 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.969 0.908 . . . . 0.0 112.799 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 . . . . . 0 CA--C 1.545 0.764 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -172.494 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 56.5 7.92 0.4 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 126.72 2.008 . . . . 0.0 115.543 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -12.44 59.99 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 119.992 -1.692 . . . . 0.0 113.906 -173.675 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -72.61 13.15 0.39 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 127.085 2.154 . . . . 0.0 114.835 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -91.32 -4.3 55.96 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.727 2.411 . . . . 0.0 114.64 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 63.6 m -138.61 -49.36 0.53 Allowed 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.994 1.718 . . . . 0.0 110.343 -172.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 44.1 pt -70.44 164.67 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.49 1.116 . . . . 0.0 111.873 176.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 65.14 -9.54 0.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 127.263 2.225 . . . . 0.0 116.346 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 46.0 mtm -93.29 -39.49 10.94 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.781 1.173 . . . . 0.0 113.945 -175.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -120.69 0.84 10.49 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -173.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 CA--C 1.541 0.617 0 C-N-CA 124.477 1.111 . . . . 0.0 111.149 -175.849 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp . . . . . 0 C--O 1.233 0.217 0 CA-C-O 122.021 0.915 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.5 t -92.06 -69.79 0.72 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.312 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -161.8 -29.95 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.64 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -99.39 0.07 41.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.996 1.318 . . . . 0.0 112.311 177.748 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -106.39 -37.11 6.61 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.189 0.904 . . . . 0.0 112.87 175.603 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -65.15 -29.41 70.24 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.776 -1.202 . . . . 0.0 112.515 174.331 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -65.66 -6.38 11.16 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.829 1.252 . . . . 0.0 114.147 170.263 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.0 mp -104.89 -55.81 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 125.52 1.528 . . . . 0.0 110.116 167.422 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.9 t -65.05 -55.93 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 119.435 1.016 . . . . 0.0 111.613 -172.324 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.96 65.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -175.397 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -34.4 73.8 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.645 -0.659 . . . . 0.0 112.572 166.849 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.72 -37.95 70.57 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.25 0.932 . . . . 0.0 111.796 172.711 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -60.16 -31.16 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 120.491 -1.381 . . . . 0.0 110.899 173.053 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 t -74.28 -13.17 60.73 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 171.997 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -102.05 -43.98 5.6 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.529 -1.357 . . . . 0.0 112.959 -167.952 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.06 -11.7 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -169.917 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 135.47 -86.44 0.25 Allowed Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.767 1.175 . . . . 0.0 111.462 170.939 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -162.56 -44.74 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.599 1.56 . . . . 0.0 111.109 176.598 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -104.24 -13.44 16.18 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.516 1.526 . . . . 0.0 114.596 -168.591 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -85.99 -16.28 38.82 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.112 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -66.33 159.78 26.03 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.981 1.312 . . . . 0.0 113.815 179.12 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -104.23 117.97 35.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.225 1.01 . . . . 0.0 110.747 178.841 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.56 -24.4 66.62 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.519 1.127 . . . . 0.0 113.63 178.84 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.6 m -68.22 -40.72 81.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.041 0.936 . . . . 0.0 111.769 173.638 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -68.01 -29.19 68.13 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.353 -1.467 . . . . 0.0 113.007 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.64 -57.71 7.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.932 0.893 . . . . 0.0 111.345 165.616 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.0 p -60.44 -24.64 65.36 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.38 1.072 . . . . 0.0 113.657 -174.87 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -67.98 -24.51 65.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.496 1.918 . . . . 0.0 114.257 173.617 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 mtm-85 -112.65 -37.08 5.01 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.818 1.647 . . . . 0.0 113.411 -179.672 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -73.8 -17.83 61.03 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.108 0.963 . . . . 0.0 112.45 171.429 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 57.69 49.9 11.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.64 1.576 . . . . 0.0 111.626 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.0 pt -113.98 175.37 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 127.254 2.222 . . . . 0.0 110.952 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.4 m -71.96 137.57 47.41 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.726 1.61 . . . . 0.0 108.854 165.881 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.5 t -57.04 -40.13 70.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 O-C-N 121.782 -0.574 . . . . 0.0 111.139 -178.602 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.18 -26.95 63.19 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.335 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -68.23 -39.33 82.34 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.739 168.903 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.05 -49.09 73.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.461 1.028 . . . . 0.0 110.433 175.926 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -54.55 -41.42 69.76 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.492 1.517 . . . . 0.0 112.866 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -87.08 -33.32 19.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 177.981 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -61.91 -38.94 90.26 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.072 -1.017 . . . . 0.0 112.508 178.072 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.7 mt -46.86 -58.04 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.093 1.357 . . . . 0.0 110.358 173.581 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -72.89 -33.21 65.9 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.413 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 . . . . . 0 N--CA 1.471 0.594 0 CA-C-N 119.202 0.91 . . . . 0.0 113.181 -178.704 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.8 p . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 48.55 27.31 1.42 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.317 1.847 . . . . 0.0 114.388 -168.974 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.8 -10.33 24.97 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.738 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -70.72 10.72 0.46 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.197 2.199 . . . . 0.0 116.38 -169.302 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -87.1 -9.56 55.04 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.322 1.849 . . . . 0.0 114.817 -169.897 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.1 m -140.56 -44.09 0.4 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.778 1.631 . . . . 0.0 110.61 -165.599 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.0 pt -62.59 169.4 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 124.402 1.081 . . . . 0.0 111.697 169.585 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt 69.13 -19.99 0.17 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.574 1.949 . . . . 0.0 115.95 176.293 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 17.1 ptp -124.44 6.99 8.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.437 1.495 . . . . 0.0 113.79 -175.699 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -146.89 -30.51 0.35 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.27 1.428 . . . . 0.0 113.331 -167.588 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 126.148 1.779 . . . . 0.0 112.41 -179.837 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 C--O 1.234 0.244 0 CA-C-O 121.894 0.854 . . . . 0.0 110.46 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -104.74 -75.07 0.63 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.894 1.678 . . . . 0.0 111.648 -178.89 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -158.83 -40.65 0.06 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.61 -31.5 71.57 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 122.178 -0.326 . . . . 0.0 110.897 172.348 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -71.01 -44.81 65.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.644 0.778 . . . . 0.0 112.004 -171.84 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt -71.41 -22.54 61.85 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.54 -1.35 . . . . 0.0 112.977 175.625 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -70.87 1.48 5.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.997 1.319 . . . . 0.0 113.973 164.814 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 mt -115.31 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.136 1.774 . . . . 0.0 110.319 168.652 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.26 -62.3 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.047 1.294 . . . . 0.0 112.069 -178.613 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.36 -33.19 74.7 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.646 -0.659 . . . . 0.0 110.991 -177.183 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.29 -23.3 65.59 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 169.608 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.67 -40.73 17.06 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.461 1.028 . . . . 0.0 111.216 172.738 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.61 -35.44 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.995 -1.065 . . . . 0.0 111.499 176.71 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.8 p -76.8 -5.21 47.32 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 174.937 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -98.76 -54.17 3.08 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.331 1.423 . . . . 0.0 112.055 177.091 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -115.58 -16.36 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -166.109 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.65 -78.88 0.36 Allowed Glycine 0 N--CA 1.467 0.717 0 C-N-CA 125.494 1.521 . . . . 0.0 111.579 167.645 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -165.94 -45.24 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.842 1.257 . . . . 0.0 112.141 174.148 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -97.33 -14.9 21.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.208 1.803 . . . . 0.0 114.381 -172.796 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -87.68 -15.62 36.65 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -171.683 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -67.69 165.35 17.37 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.914 1.285 . . . . 0.0 112.115 165.023 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.6 p30 -119.35 169.46 9.98 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.466 1.127 . . . . 0.0 112.043 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.2 -26.5 39.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.667 1.187 . . . . 0.0 112.819 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -63.71 -51.58 64.38 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.953 1.301 . . . . 0.0 111.275 -179.161 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -62.89 -39.03 93.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.528 0.731 . . . . 0.0 111.587 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.33 -46.03 90.52 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.294 0.637 . . . . 0.0 111.608 174.289 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.4 p -62.04 -25.81 67.89 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.984 -1.073 . . . . 0.0 113.685 177.998 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -84.27 -39.05 19.72 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.487 1.515 . . . . 0.0 112.021 -177.187 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -91.16 -38.68 12.58 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.259 1.024 . . . . 0.0 113.348 -179.762 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.01 -19.88 42.99 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.561 1.144 . . . . 0.0 113.072 177.976 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 61.76 69.33 0.65 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.876 1.67 . . . . 0.0 112.143 -177.49 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.5 pt -137.42 168.39 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 126.734 2.013 . . . . 0.0 111.467 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.7 m -60.81 139.21 58.01 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.413 1.485 . . . . 0.0 110.147 162.496 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -61.12 -35.29 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.28 -0.887 . . . . 0.0 111.511 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.79 -30.01 66.36 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.095 -1.003 . . . . 0.0 113.377 177.551 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.47 -40.05 94.96 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.82 167.971 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.07 -48.42 73.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.194 0.906 . . . . 0.0 110.962 177.254 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -56.1 -40.84 74.29 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.797 1.239 . . . . 0.0 112.476 179.474 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -88.4 -33.68 17.81 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.19 -38.31 90.69 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.237 1.015 . . . . 0.0 112.359 177.48 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.5 mt -48.92 -52.54 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.216 1.006 . . . . 0.0 110.651 175.464 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -80.85 -32.33 35.09 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 . . . . . 0 CA--C 1.541 0.634 0 CA-C-N 119.882 1.219 . . . . 0.0 113.179 -179.024 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.8 m120 48.45 32.36 3.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.887 1.675 . . . . 0.0 113.436 -167.327 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.29 -5.38 19.17 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.254 1.422 . . . . 0.0 114.478 -179.464 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -75.45 13.82 0.7 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.512 1.925 . . . . 0.0 115.526 -168.573 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -91.47 11.85 22.65 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.685 1.994 . . . . 0.0 113.752 -163.897 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.6 m -150.94 -47.84 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.658 2.783 . . . . 0.0 108.604 -169.858 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -73.99 156.08 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.224 1.01 . . . . 0.0 109.454 179.371 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.47 -7.11 0.57 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 127.411 2.284 . . . . 0.0 116.438 -178.683 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 37.2 mtm -96.91 -50.59 4.58 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.946 1.248 . . . . 0.0 113.678 -174.705 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -91.41 -7.67 50.05 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -176.556 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 . . . . . 0 N--CA 1.474 0.757 0 C-N-CA 125.221 1.408 . . . . 0.0 114.247 -168.699 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -82.73 -71.37 0.5 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.996 0.918 . . . . 0.0 112.726 -175.536 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -163.57 -35.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.101 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -29.22 47.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.74 0.416 . . . . 0.0 111.095 170.906 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -77.62 -42.64 34.21 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.569 1.548 . . . . 0.0 112.045 -168.576 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -68.73 -26.14 65.11 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.228 -0.92 . . . . 0.0 113.035 173.752 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -68.9 -1.09 6.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.164 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 mt -113.86 -45.23 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.414 1.486 . . . . 0.0 110.209 172.078 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 36.4 t -73.55 -64.16 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 CA-C-N 119.459 1.027 . . . . 0.0 112.01 179.07 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.01 -27.42 65.66 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.786 -0.571 . . . . 0.0 112.377 -174.819 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.67 -42.36 78.89 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 165.699 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -36.45 81.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.905 0.882 . . . . 0.0 111.736 175.557 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.4 mm -62.84 -22.11 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 120.861 -1.149 . . . . 0.0 111.429 175.023 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 t -83.79 -11.16 57.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 171.905 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -96.93 -60.03 1.68 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.522 -1.361 . . . . 0.0 112.099 -175.835 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -113.46 -17.47 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 N-CA-C 114.922 1.452 . . . . 0.0 114.922 -164.535 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.47 -83.87 0.26 Allowed Glycine 0 N--CA 1.465 0.632 0 C-N-CA 125.349 1.452 . . . . 0.0 111.171 167.615 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -161.3 -46.7 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.58 1.152 . . . . 0.0 112.333 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -96.97 -20.31 18.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.189 1.796 . . . . 0.0 114.472 -174.765 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -84.65 -11.26 56.29 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -167.627 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.31 163.03 23.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.178 1.791 . . . . 0.0 114.417 176.4 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -87.75 -172.41 3.85 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.77 1.628 . . . . 0.0 109.991 174.572 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -120.82 -19.22 7.4 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.038 1.335 . . . . 0.0 112.964 167.379 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.9 m -72.26 -53.41 12.57 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.401 1.08 . . . . 0.0 112.286 -173.415 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.2 -25.03 65.02 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 120.75 -1.219 . . . . 0.0 113.673 179.764 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.28 -58.89 4.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.517 0.727 . . . . 0.0 111.101 166.566 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.5 p -61.1 -25.62 67.09 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -177.121 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -69.06 -41.16 77.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.567 1.547 . . . . 0.0 113.082 171.569 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -89.73 -37.95 14.19 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.272 1.429 . . . . 0.0 112.879 -174.967 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -20.33 57.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.103 1.361 . . . . 0.0 113.172 171.028 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.21 58.91 2.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.833 1.253 . . . . 0.0 111.398 -177.717 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.0 pt -123.25 174.47 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 127.069 2.147 . . . . 0.0 110.185 174.194 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 51.7 m -70.36 141.29 52.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.643 1.577 . . . . 0.0 109.515 166.783 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.3 t -58.58 -39.39 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 O-C-N 121.426 -0.796 . . . . 0.0 111.057 179.442 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -70.52 -28.5 64.99 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.359 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -66.34 -39.52 89.28 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.125 -0.941 . . . . 0.0 110.786 168.796 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.65 72.22 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.251 0.932 . . . . 0.0 110.544 176.208 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -54.87 -37.73 66.63 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.088 1.355 . . . . 0.0 113.044 -179.143 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -86.51 -41.23 14.52 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 118.792 0.724 . . . . 0.0 112.732 174.695 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -61.33 -34.78 75.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.067 -1.02 . . . . 0.0 113.066 -177.787 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.0 mt -46.66 -62.75 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.134 1.374 . . . . 0.0 110.027 171.38 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -76.32 -19.11 58.56 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -179.417 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 . . . . . 0 CA--C 1.544 0.744 0 CA-C-N 118.832 0.742 . . . . 0.0 112.502 177.222 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.3 m120 53.9 26.39 6.19 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.252 1.821 . . . . 0.0 115.049 -174.568 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -8.61 40.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.495 1.118 . . . . 0.0 113.917 -178.514 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 p90 -70.37 7.31 1.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.931 2.092 . . . . 0.0 116.619 -168.635 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 -4.62 59.21 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.448 1.499 . . . . 0.0 114.796 -169.8 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.5 m -141.88 -46.53 0.36 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.02 1.728 . . . . 0.0 109.93 -167.147 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.6 169.8 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 123.637 0.775 . . . . 0.0 111.329 173.69 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 69.06 -14.29 0.31 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.051 2.14 . . . . 0.0 115.5 -174.907 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 13.43 2.2 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 178.339 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -146.54 38.14 1.02 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.226 1.01 . . . . 0.0 112.904 -173.334 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 . . . . . 0 CA--C 1.543 0.683 0 C-N-CA 124.792 1.237 . . . . 0.0 112.975 -168.05 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 121.636 0.731 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.6 p -126.46 -69.64 0.76 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.667 1.587 . . . . 0.0 112.378 174.786 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.89 -34.31 0.05 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -167.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -76.83 -13.98 59.95 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.568 0.747 . . . . 0.0 111.278 172.347 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 mp0 -86.87 -43.65 12.29 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.097 0.862 . . . . 0.0 112.719 -177.304 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.32 -32.9 74.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.153 -0.967 . . . . 0.0 112.367 178.514 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -64.5 -2.79 2.52 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 115.548 1.685 . . . . 0.0 115.548 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.8 mt -112.12 -17.4 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.734 1.613 . . . . 0.0 112.276 174.443 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 17.9 t -127.68 -53.14 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.187 0.903 . . . . 0.0 113.373 -172.962 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.82 -37.89 88.54 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.778 1.172 . . . . 0.0 110.845 171.972 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.95 -28.3 69.43 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.992 0.917 . . . . 0.0 113.054 170.749 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -37.84 59.24 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.307 1.043 . . . . 0.0 111.59 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.5 -33.78 55.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.937 -1.102 . . . . 0.0 110.773 170.327 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -72.57 -10.31 59.64 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 169.67 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -107.53 -42.72 4.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.499 1.499 . . . . 0.0 112.987 -172.874 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.0 m -127.99 -13.19 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -173.082 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -83.35 0.3 Allowed Glycine 0 N--CA 1.469 0.89 0 C-N-CA 124.931 1.253 . . . . 0.0 112.223 169.092 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.8 tt -167.85 -44.5 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.123 1.769 . . . . 0.0 111.01 -177.504 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -107.44 -10.57 15.71 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.174 1.79 . . . . 0.0 114.913 -168.987 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -89.2 -20.34 24.31 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -176.39 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.15 162.82 23.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.638 1.175 . . . . 0.0 112.116 166.48 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -120.73 174.24 6.71 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.526 1.155 . . . . 0.0 112.007 174.805 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.1 -23.95 35.43 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.906 1.282 . . . . 0.0 112.995 179.355 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.7 m -63.36 -51.4 66.09 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.252 1.421 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -64.33 -39.07 93.16 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.41 -0.806 . . . . 0.0 112.183 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.33 -51.03 71.5 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 168.537 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.5 p -60.14 -24.86 65.03 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.686 -1.259 . . . . 0.0 113.831 -178.529 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -87.15 -47.93 8.48 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.177 1.791 . . . . 0.0 111.922 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -90.24 -29.53 18.13 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.368 1.067 . . . . 0.0 113.39 -174.855 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.2 tp -93.99 -14.57 25.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.759 1.624 . . . . 0.0 112.785 178.623 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.16 66.59 0.94 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.307 1.843 . . . . 0.0 112.644 175.569 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 pt -142.94 167.56 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 127.263 2.225 . . . . 0.0 111.078 -179.059 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.407 HG22 ' H ' ' A' ' 69' ' ' ASP . 7.4 m -53.93 139.55 33.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.581 1.552 . . . . 0.0 110.813 164.487 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 t -58.31 -38.54 69.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 121.602 -0.686 . . . . 0.0 111.149 175.326 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.407 ' H ' HG22 ' A' ' 67' ' ' THR . 20.0 m-20 -72.9 -28.67 62.62 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.132 -0.98 . . . . 0.0 113.356 -179.978 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -66.57 -37.43 84.92 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.498 -0.763 . . . . 0.0 110.937 168.139 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.12 -47.49 73.96 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.843 0.747 . . . . 0.0 110.555 174.954 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -57.28 -38.85 74.57 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.24 1.016 . . . . 0.0 112.738 -179.544 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -89.6 -31.64 17.48 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -63.65 -38.04 89.61 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 120.585 -1.322 . . . . 0.0 112.138 176.492 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.9 mt -49.66 -56.67 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.143 0.977 . . . . 0.0 110.545 174.648 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -70.93 -35.76 72.37 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 179.106 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 . . . . . 0 N--CA 1.474 0.727 0 CA-C-N 119.348 0.976 . . . . 0.0 112.965 178.91 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 121.814 0.816 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.89 25.14 15.11 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.922 2.089 . . . . 0.0 113.426 165.16 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -87.96 -10.05 51.68 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.414 1.485 . . . . 0.0 113.449 -173.942 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -76.05 15.47 0.55 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.679 2.392 . . . . 0.0 114.59 -176.895 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 32.4 pttt -83.34 -6.71 59.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.22 2.608 . . . . 0.0 114.191 -171.14 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 44.3 m -143.16 -54.54 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 126.586 1.955 . . . . 0.0 109.806 -172.486 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.5 pt -71.98 164.74 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.038 0.935 . . . . 0.0 111.91 177.81 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 -4.41 0.48 Allowed 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -178.617 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 44.3 mtm -97.83 -49.49 4.79 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.764 1.166 . . . . 0.0 113.627 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -107.26 -7.29 16.8 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -175.408 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.54 0.586 0 C-N-CA 125.127 1.371 . . . . 0.0 111.568 -174.1 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 CA--C 1.535 0.374 0 CA-C-O 121.536 0.684 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.6 m -116.7 -70.21 0.81 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.308 1.843 . . . . 0.0 112.68 -175.182 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -161.82 -41.21 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -171.682 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.1 -27.6 61.8 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.627 . . . . 0.0 110.866 174.198 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -72.91 -33.93 66.29 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.872 1.269 . . . . 0.0 110.803 -176.087 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -70.21 -34.5 72.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.879 0.871 . . . . 0.0 112.296 170.509 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -65.46 -3.73 4.77 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 171.027 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 mt -107.85 -53.89 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.772 1.629 . . . . 0.0 110.124 167.967 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.21 -62.85 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 124.194 0.998 . . . . 0.0 112.148 -174.431 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.93 66.88 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.593 0.757 . . . . 0.0 111.903 -177.113 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.12 -44.8 83.65 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.792 0.437 . . . . 0.0 111.945 164.738 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.03 -38.11 89.87 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.343 1.057 . . . . 0.0 112.47 174.806 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -62.6 -19.4 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.941 0.897 . . . . 0.0 111.632 176.182 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -88.18 -13.07 42.08 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.98 1.312 . . . . 0.0 114.26 172.305 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -96.82 -55.57 2.84 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.544 -1.348 . . . . 0.0 112.207 -175.14 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.9 m -118.64 -18.11 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -167.551 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.23 -85.79 0.32 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 125.775 1.655 . . . . 0.0 111.049 169.664 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.5 tp -167.04 -36.6 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.947 1.299 . . . . 0.0 112.919 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -104.53 -9.43 18.34 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.01 1.324 . . . . 0.0 114.035 -173.996 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -97.23 -14.74 21.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.568 1.147 . . . . 0.0 113.412 -175.82 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -70.59 164.33 25.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.071 1.348 . . . . 0.0 111.942 170.07 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -121.9 167.72 12.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.294 1.045 . . . . 0.0 112.114 174.182 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.08 -25.52 43.07 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.397 1.079 . . . . 0.0 112.668 -178.421 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.7 m -64.41 -45.49 87.35 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.67 1.588 . . . . 0.0 112.208 -179.113 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -65.52 -36.93 85.27 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.611 -1.305 . . . . 0.0 112.231 176.826 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.27 -49.24 72.62 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.4 0.68 . . . . 0.0 111.818 172.35 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.3 p -64.98 -25.69 67.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.046 0.938 . . . . 0.0 113.312 -179.083 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -76.11 -35.61 59.22 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.159 1.384 . . . . 0.0 112.712 177.11 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.6 mmm-85 -100.13 -32.77 10.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.981 1.312 . . . . 0.0 113.452 -172.397 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.3 mt -86.8 -19.31 29.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.103 1.361 . . . . 0.0 112.829 173.194 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.63 57.73 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.277 1.431 . . . . 0.0 112.072 -176.09 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.8 pt -120.28 167.4 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 127.747 2.419 . . . . 0.0 109.928 175.828 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.2 t -70.91 151.42 44.73 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.392 -0.817 . . . . 0.0 110.747 165.679 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.79 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.006 0.922 . . . . 0.0 111.262 -177.41 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -67.46 -32.63 73.62 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 179.688 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.77 -35.29 76.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.206 171.911 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.25 -47.39 67.9 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.809 0.731 . . . . 0.0 110.636 175.726 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -57.04 -41.96 79.62 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.231 1.412 . . . . 0.0 112.831 179.249 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 t -83.86 -34.08 24.68 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.173 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -65.71 -36.19 82.9 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.972 -1.08 . . . . 0.0 112.32 176.899 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.7 mt -51.13 -60.44 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.098 0.959 . . . . 0.0 109.841 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -54.14 -26.9 30.14 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 127.472 2.309 . . . . 0.0 115.802 174.422 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 . . . . . 0 CA--C 1.545 0.776 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 176.774 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 65.54 37.13 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 128.038 2.535 . . . . 0.0 111.868 166.002 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -78.29 -19.43 53.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.398 1.879 . . . . 0.0 114.942 -177.694 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -110.95 20.34 17.6 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.787 1.235 . . . . 0.0 112.78 -150.715 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -86.66 9.05 19.88 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 128.211 2.605 . . . . 0.0 114.721 -173.978 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.9 m -146.38 -49.32 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.439 1.895 . . . . 0.0 109.699 -169.327 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -80.86 155.38 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.411 1.485 . . . . 0.0 109.417 179.483 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? 64.04 14.19 8.3 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 126.011 1.724 . . . . 0.0 115.316 -178.6 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 20.9 mtm -115.48 -21.34 9.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 -178.048 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -129.27 -6.1 4.84 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -174.98 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 125.218 1.407 . . . . 0.0 113.018 -174.142 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 121.494 0.664 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 62.6 m -115.88 -68.98 0.88 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.162 1.785 . . . . 0.0 112.27 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -163.82 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 123.452 0.701 . . . . 0.0 111.443 -171.004 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -68.56 -28.83 67.31 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.547 1.139 . . . . 0.0 110.264 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -72.81 -34.89 67.16 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.475 1.11 . . . . 0.0 112.062 178.667 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -70.4 -34.98 73.16 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.848 -1.158 . . . . 0.0 112.491 173.085 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -60.89 -6.32 1.76 Allowed 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 168.724 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.3 mt -108.13 -56.79 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.84 1.656 . . . . 0.0 110.342 169.419 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.1 t -69.18 -61.79 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 123.856 0.862 . . . . 0.0 111.373 -173.599 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.38 70.56 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.358 0.663 . . . . 0.0 111.829 -177.097 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.06 -44.61 87.56 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 122.889 0.475 . . . . 0.0 112.197 167.681 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -36.75 80.92 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.992 0.917 . . . . 0.0 112.257 175.329 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.1 mm -60.56 -28.32 42.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.772 -1.205 . . . . 0.0 110.655 175.664 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -77.14 -14.75 59.74 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 173.074 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -93.74 -54.28 3.69 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.398 -1.439 . . . . 0.0 112.115 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.3 m -118.63 -13.17 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -164.709 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.7 -77.31 0.4 Allowed Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.365 1.46 . . . . 0.0 112.106 166.438 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.9 tp -163.66 -43.5 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.321 1.449 . . . . 0.0 111.854 170.758 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -108.96 -5.6 16.03 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -167.606 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -89.7 -17.71 27.82 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.037 0.935 . . . . 0.0 112.993 -176.956 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.36 164.46 9.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.802 1.241 . . . . 0.0 112.528 165.863 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -110.36 167.01 10.52 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 122.292 1.044 . . . . 0.0 111.466 171.423 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.04 -24.25 37.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.145 0.978 . . . . 0.0 112.412 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.39 -45.25 93.96 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.192 1.797 . . . . 0.0 112.519 -179.49 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -65.26 -41.82 93.88 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.639 -1.288 . . . . 0.0 111.989 176.951 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.52 -46.06 90.13 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.657 -0.652 . . . . 0.0 111.912 174.235 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.7 p -65.37 -23.47 66.98 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.182 -0.949 . . . . 0.0 113.402 179.366 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.03 1.332 . . . . 0.0 112.389 176.253 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -102.74 -40.22 6.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.363 1.465 . . . . 0.0 113.072 -169.944 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.4 mp -81.03 -17.77 49.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.606 1.162 . . . . 0.0 113.207 170.304 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.92 58.24 2.83 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-O 122.693 1.235 . . . . 0.0 111.49 -175.282 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.1 pt -122.79 164.56 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 128.011 2.524 . . . . 0.0 109.532 177.024 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 t -70.64 153.49 42.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 121.243 -0.91 . . . . 0.0 110.766 167.568 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -58.3 -37.69 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.869 0.868 . . . . 0.0 111.167 -177.366 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.62 -29.99 68.62 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 179.396 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -67.3 -38.36 84.85 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.096 170.338 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.66 -48.12 67.56 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.632 0.651 . . . . 0.0 110.329 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -56.47 -32.41 64.94 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.95 1.7 . . . . 0.0 113.987 178.751 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -90.25 -42.05 11.22 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.968 0.804 . . . . 0.0 112.822 173.454 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.6 -35.77 72.96 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.899 -1.126 . . . . 0.0 113.333 -178.393 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.6 mt -50.37 -42.47 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 0.0 112.25 174.231 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -94.59 -25.76 16.66 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 176.396 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 . . . . . 0 CA--C 1.543 0.687 0 CA-C-N 118.819 0.736 . . . . 0.0 112.952 -179.724 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 41.1 p . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 123.247 1.499 . . . . 0.0 113.332 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -84.58 -8.0 59.06 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.457 2.303 . . . . 0.0 112.002 -173.998 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.4 -17.59 59.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 128.389 2.676 . . . . 0.0 113.163 176.666 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -71.52 15.69 0.13 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.015 2.126 . . . . 0.0 115.81 -174.709 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' A' ' 88' ' ' LYS . 31.6 mtmt -66.82 100.12 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.318 -1.489 . . . . 0.0 109.573 -176.085 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 75.79 2.58 3.72 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.385 2.674 . . . . 0.0 114.827 -176.623 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.2 mt -117.66 145.72 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.898 1.279 . . . . 0.0 109.993 -175.464 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 60.52 14.27 4.75 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.643 1.577 . . . . 0.0 114.344 -169.777 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.7 ptm -138.01 9.69 2.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.984 1.713 . . . . 0.0 114.02 -178.696 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -145.69 -36.05 0.29 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.03 1.492 . . . . 0.0 115.03 -163.099 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 . . . . . 0 N--CA 1.474 0.738 0 O-C-N 121.355 -0.84 . . . . 0.0 112.9 -175.266 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.424 0.63 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -93.08 -78.41 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 125.489 1.516 . . . . 0.0 111.188 170.231 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -156.56 -46.13 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 122.971 0.508 . . . . 0.0 111.156 -172.978 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -65.83 -29.72 70.23 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.438 0.695 . . . . 0.0 111.683 175.542 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -73.63 -45.9 50.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.954 0.901 . . . . 0.0 111.866 -169.273 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -67.12 -28.14 67.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.221 1.009 . . . . 0.0 112.63 169.926 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -69.74 -1.74 10.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.803 1.241 . . . . 0.0 114.087 170.045 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -106.54 -53.76 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.149 1.38 . . . . 0.0 109.932 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.5 t -72.39 -59.15 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.092 0.86 . . . . 0.0 112.066 -174.694 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.87 64.48 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.495 0.589 . . . . 0.0 112.294 -177.41 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.18 -44.56 94.96 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.661 -0.65 . . . . 0.0 112.392 164.633 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.93 -34.31 77.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.053 0.842 . . . . 0.0 111.945 175.582 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -61.52 -22.66 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 O-C-N 120.559 -1.338 . . . . 0.0 112.023 174.154 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 t -83.63 -12.79 55.53 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.557 1.143 . . . . 0.0 114.065 171.952 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -93.41 -56.37 2.96 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.635 -1.291 . . . . 0.0 112.284 -175.607 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.3 m -122.94 -17.23 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 -165.611 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 130.45 -89.08 0.3 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 125.758 1.647 . . . . 0.0 110.413 172.711 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 54.3 tp -163.72 -36.33 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.101 1.36 . . . . 0.0 113.066 177.921 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -107.68 -2.66 19.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -173.287 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -94.91 -17.84 21.66 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.241 1.016 . . . . 0.0 112.955 178.771 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -73.43 164.41 26.7 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.336 1.454 . . . . 0.0 111.924 169.634 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.9 p30 -115.39 172.61 6.99 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.194 0.997 . . . . 0.0 111.653 170.828 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.79 -21.36 29.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.427 1.091 . . . . 0.0 112.611 178.571 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.0 m -63.25 -50.19 71.16 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.892 1.677 . . . . 0.0 111.643 -178.346 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -66.37 -45.53 79.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.829 -1.169 . . . . 0.0 112.276 -179.296 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -52.29 -54.31 32.96 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.504 1.122 . . . . 0.0 112.241 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.4 p -66.88 -27.99 67.96 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -177.599 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -70.8 -46.76 62.25 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.086 1.355 . . . . 0.0 112.637 173.324 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 66.1 mtt85 -78.46 -40.61 35.12 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.21 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -85.45 -19.01 31.92 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.395 1.478 . . . . 0.0 111.747 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.23 66.52 0.71 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.0 1.72 . . . . 0.0 111.92 179.069 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -132.37 172.75 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 127.004 2.121 . . . . 0.0 110.956 178.907 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 55.0 m -66.05 137.72 57.28 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.226 1.41 . . . . 0.0 109.05 165.625 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.7 t -57.41 -38.97 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 O-C-N 121.716 -0.615 . . . . 0.0 110.984 -179.131 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.87 -26.53 64.24 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.815 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -66.78 -39.49 87.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.566 -0.73 . . . . 0.0 111.268 169.526 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.53 -45.72 74.91 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.901 0.773 . . . . 0.0 110.299 175.031 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -54.79 -42.24 71.52 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.765 1.226 . . . . 0.0 112.608 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -83.4 -38.06 22.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 176.948 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.62 -33.75 75.63 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.067 -1.021 . . . . 0.0 113.277 -178.503 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -49.13 -47.0 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.988 1.315 . . . . 0.0 111.418 172.58 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -87.32 -26.88 23.17 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 175.694 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 . . . . . 0 CA--C 1.543 0.694 0 CA-C-N 119.192 0.906 . . . . 0.0 112.632 -179.29 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 72.3 p . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 57.3 40.56 27.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.739 1.615 . . . . 0.0 111.616 -171.676 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -82.05 -19.07 41.04 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.536 1.535 . . . . 0.0 114.865 -174.849 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -116.06 10.61 15.09 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -141.824 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -85.12 -6.53 59.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.354 1.862 . . . . 0.0 115.02 -167.53 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.1 m -144.45 -46.39 0.25 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.709 1.603 . . . . 0.0 110.993 -164.094 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.2 pt -75.93 174.37 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.044 1.338 . . . . 0.0 111.889 175.128 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 65.21 -15.69 0.1 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 127.18 2.192 . . . . 0.0 116.16 -175.039 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.0 ptm -123.85 1.13 8.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.708 1.603 . . . . 0.0 114.241 -176.757 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -134.2 -9.59 2.6 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -166.13 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 . . . . . 0 N--CA 1.472 0.635 0 C-N-CA 124.849 1.26 . . . . 0.0 110.813 -173.76 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 CA--C 1.535 0.385 0 CA-C-O 121.851 0.834 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.4 t -112.86 -77.22 0.58 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 127.42 2.288 . . . . 0.0 111.544 179.53 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -155.7 -40.98 0.08 Allowed 'General case' 0 C--N 1.327 -0.41 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -67.7 -28.76 67.95 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.546 0.739 . . . . 0.0 111.008 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.6 mp0 -71.84 -32.4 67.49 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.812 -0.555 . . . . 0.0 112.35 179.574 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mttt -70.08 -34.84 73.68 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 120.889 -1.132 . . . . 0.0 112.779 170.971 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -64.46 0.48 1.04 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 169.115 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -112.54 -52.2 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 126.531 1.932 . . . . 0.0 110.924 167.492 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 64.0 t -74.05 -59.97 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.905 0.775 . . . . 0.0 112.275 -175.061 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.05 -28.78 68.49 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.35 -11.32 40.92 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 167.874 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.04 -36.88 11.36 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.212 1.405 . . . . 0.0 111.299 167.132 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.7 mm -63.72 -27.55 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 O-C-N 120.518 -1.364 . . . . 0.0 112.027 178.915 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.0 p -68.43 -19.83 64.61 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 168.336 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -106.96 -42.06 5.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.173 0.897 . . . . 0.0 113.168 -157.526 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -128.03 -14.67 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.741 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.76 -93.33 0.29 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 125.821 1.677 . . . . 0.0 110.173 173.913 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -164.0 -28.78 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.636 1.574 . . . . 0.0 113.372 175.666 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -108.35 -12.91 14.98 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 114.603 -172.007 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -91.89 -20.18 21.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.121 0.968 . . . . 0.0 112.938 -175.857 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.0 pp -67.87 164.0 20.7 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.637 1.575 . . . . 0.0 112.187 166.62 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.06 171.25 7.78 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.374 1.083 . . . . 0.0 111.946 172.276 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -20.75 32.37 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.102 1.361 . . . . 0.0 113.005 -179.166 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.9 m -67.74 -46.99 70.55 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.835 1.654 . . . . 0.0 111.807 -178.564 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -65.8 -45.13 83.52 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.114 -0.991 . . . . 0.0 112.041 178.769 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -52.48 -56.34 15.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.085 0.554 . . . . 0.0 112.103 168.969 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.8 p -64.69 -21.84 66.84 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.235 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -74.03 -48.66 28.51 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.591 1.557 . . . . 0.0 112.187 173.377 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -76.11 -39.42 55.24 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.89 0.876 . . . . 0.0 112.636 179.762 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.3 mt -81.72 -21.99 37.61 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.094 1.357 . . . . 0.0 113.164 -179.125 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.65 58.5 2.85 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.335 1.454 . . . . 0.0 111.991 -176.764 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.4 pt -123.71 178.44 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 127.68 2.392 . . . . 0.0 109.644 175.358 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -76.59 147.88 37.34 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.494 -0.754 . . . . 0.0 110.843 164.438 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.2 t -53.76 -35.13 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.109 1.363 . . . . 0.0 110.982 175.189 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.25 -24.22 62.13 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 -176.205 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -78.19 -37.4 45.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.081 0.855 . . . . 0.0 111.253 168.934 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.28 -47.85 75.24 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.701 0.682 . . . . 0.0 110.132 -179.094 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -64.43 -30.78 71.81 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -175.448 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -89.99 -33.25 16.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.906 0.776 . . . . 0.0 112.709 174.899 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.09 -37.09 85.81 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.067 -1.021 . . . . 0.0 112.483 177.772 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -50.32 -63.12 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.361 1.064 . . . . 0.0 110.22 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -63.63 -29.76 70.96 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -179.744 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 . . . . . 0 CA--C 1.544 0.738 0 CA-C-N 119.065 0.848 . . . . 0.0 112.885 174.722 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.6 p . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 46.95 34.14 2.57 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 126.467 1.907 . . . . 0.0 113.564 -167.254 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.4 -9.01 19.76 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -177.475 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -71.48 14.87 0.15 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 127.074 2.149 . . . . 0.0 115.516 -172.805 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -92.23 -4.55 53.93 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.982 2.513 . . . . 0.0 115.048 -166.025 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 57.2 m -145.77 -46.12 0.21 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.103 1.761 . . . . 0.0 110.475 -168.544 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.4 pt -64.65 167.16 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.57 1.148 . . . . 0.0 111.575 173.902 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 67.07 -9.9 0.35 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 126.496 1.919 . . . . 0.0 115.928 -176.669 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -143.59 19.65 1.85 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.659 1.118 . . . . 0.0 113.792 -176.674 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -152.49 -40.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.424 1.089 . . . . 0.0 112.921 -176.144 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 124.847 1.259 . . . . 0.0 112.699 175.742 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 mp . . . . . 0 C--O 1.234 0.264 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 85.1 p -97.76 -71.4 0.69 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.641 1.176 . . . . 0.0 111.667 169.026 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -163.67 -34.31 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 124.575 1.15 . . . . 0.0 111.666 -168.354 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.83 -32.81 46.32 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.819 -0.55 . . . . 0.0 111.705 173.742 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -75.09 -39.16 60.94 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.174 -0.954 . . . . 0.0 112.527 -170.077 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -67.66 -28.51 67.76 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.27 -0.894 . . . . 0.0 112.406 172.787 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -67.5 -6.88 21.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 168.476 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -101.56 -39.72 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.012 1.325 . . . . 0.0 111.052 170.825 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.6 t -90.48 -54.15 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 119.059 0.845 . . . . 0.0 113.141 -174.563 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.14 -35.66 81.5 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.104 0.865 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.26 -33.43 71.03 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.22 -38.09 60.83 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.095 -1.003 . . . . 0.0 111.767 176.442 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -61.84 -26.99 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 120.858 -1.151 . . . . 0.0 111.229 173.009 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.4 m -79.51 -12.13 59.88 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 170.187 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.7 -39.5 6.32 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.622 1.101 . . . . 0.0 112.821 -172.462 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -132.64 -15.53 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -171.58 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.37 -82.1 0.34 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 125.417 1.484 . . . . 0.0 111.62 171.377 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 35.6 tp -171.66 -34.51 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.471 1.908 . . . . 0.0 111.236 177.026 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -107.69 -5.59 17.33 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -167.05 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -99.09 -22.46 15.68 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.99 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -62.65 157.94 19.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.917 1.287 . . . . 0.0 112.612 171.02 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.56 172.67 6.78 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.493 1.139 . . . . 0.0 112.094 177.617 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -18.55 30.27 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.988 1.315 . . . . 0.0 112.739 -179.058 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.7 m -66.5 -50.24 63.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.689 1.596 . . . . 0.0 111.417 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -65.92 -45.37 82.14 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.964 -1.085 . . . . 0.0 111.973 179.813 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mp -53.25 -52.73 58.06 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.763 0.825 . . . . 0.0 112.862 170.035 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.7 p -63.6 -28.22 69.78 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 120.738 -1.226 . . . . 0.0 113.669 -179.351 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -75.81 -44.24 42.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.3 1.44 . . . . 0.0 112.783 177.312 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.6 mmt-85 -86.89 -39.21 16.02 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.586 1.154 . . . . 0.0 113.742 -176.557 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -85.06 -17.74 36.49 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.691 1.597 . . . . 0.0 111.663 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 61.66 64.14 1.07 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.978 1.711 . . . . 0.0 111.825 178.892 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 16.0 pt -132.53 162.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 127.547 2.339 . . . . 0.0 109.104 178.502 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.1 t -68.35 149.92 48.81 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.495 -0.753 . . . . 0.0 110.338 166.87 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.4 t -57.43 -34.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.987 0.915 . . . . 0.0 111.078 -177.853 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.35 -33.12 73.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 178.781 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -67.72 -35.44 78.77 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.915 0.78 . . . . 0.0 111.181 171.317 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.82 -48.78 62.7 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.796 0.726 . . . . 0.0 110.615 176.421 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -57.81 -32.11 67.24 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.564 1.546 . . . . 0.0 113.665 179.051 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.1 t -89.71 -43.18 10.88 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.024 0.829 . . . . 0.0 113.003 174.761 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -58.75 -36.95 75.18 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.76 1.164 . . . . 0.0 113.129 -177.988 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mt -48.96 -48.09 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 125.063 1.345 . . . . 0.0 111.731 173.884 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -91.66 -25.34 19.18 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 179.438 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 . . . . . 0 CA--C 1.544 0.716 0 CA-C-N 119.397 0.999 . . . . 0.0 112.38 179.493 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.6 m . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -153.11 28.09 0.52 Allowed 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.418 168.935 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -111.85 33.58 4.71 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.979 1.712 . . . . 0.0 111.967 -172.511 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -124.99 17.52 8.52 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.764 1.626 . . . . 0.0 113.21 -173.808 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -76.82 -6.17 51.23 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.107 2.163 . . . . 0.0 115.873 -175.593 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.0 t -137.17 -38.63 0.61 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.434 1.494 . . . . 0.0 112.137 177.146 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.1 mt -63.23 157.85 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.299 1.44 . . . . 0.0 109.178 167.615 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.5 -24.2 0.06 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 127.321 2.248 . . . . 0.0 116.858 -177.29 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -101.83 -25.71 13.72 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.122 1.369 . . . . 0.0 114.439 175.894 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.08 -4.68 59.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 171.387 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 . . . . . 0 CA--C 1.544 0.726 0 C-N-CA 125.513 1.525 . . . . 0.0 112.077 -178.961 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 t -76.96 -79.56 0.11 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.503 1.121 . . . . 0.0 112.886 -173.39 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.47 -44.06 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.579 0.752 . . . . 0.0 111.403 -170.754 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -72.57 -28.34 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.027 0.531 . . . . 0.0 111.08 171.797 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -72.36 -49.73 32.01 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.448 1.099 . . . . 0.0 112.043 -171.167 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -65.37 -25.47 67.58 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.304 -1.497 . . . . 0.0 113.481 172.188 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -66.95 -5.54 13.12 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 167.478 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.31 -52.68 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.121 1.368 . . . . 0.0 110.043 167.153 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.8 t -79.41 -51.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.039 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.41 -32.95 74.18 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 118.982 0.81 . . . . 0.0 110.948 179.065 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.03 -36.35 74.82 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 167.773 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -40.67 70.34 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.123 -0.986 . . . . 0.0 111.776 175.72 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.2 -31.16 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 O-C-N 120.86 -1.15 . . . . 0.0 111.133 172.233 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -72.79 -17.23 61.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 171.693 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -102.49 -42.72 5.86 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.725 -1.234 . . . . 0.0 112.641 -170.665 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.98 -12.86 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -171.871 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.21 -82.54 0.34 Allowed Glycine 0 N--CA 1.469 0.852 0 C-N-CA 125.389 1.471 . . . . 0.0 112.59 167.095 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 65.5 tp -167.64 -36.27 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.263 1.825 . . . . 0.0 111.666 -179.117 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -112.29 -10.14 13.83 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.189 1.396 . . . . 0.0 114.645 -167.475 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -93.43 -15.31 25.75 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.158 0.983 . . . . 0.0 112.886 179.233 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -71.78 164.92 25.11 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.23 1.412 . . . . 0.0 113.533 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -110.13 118.63 36.9 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.637 1.175 . . . . 0.0 111.626 -179.501 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.7 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.639 1.176 . . . . 0.0 113.389 176.501 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.8 m -69.43 -41.38 76.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.313 -0.867 . . . . 0.0 111.543 173.543 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -61.3 -41.26 96.69 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.796 -1.19 . . . . 0.0 111.736 172.71 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.87 -46.32 81.89 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.675 -0.64 . . . . 0.0 111.795 168.787 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.1 p -60.59 -22.41 63.68 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.516 -1.365 . . . . 0.0 113.887 178.821 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -94.66 -43.04 8.46 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.114 1.766 . . . . 0.0 112.064 -175.492 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.4 mmt85 -79.22 -37.61 37.69 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.249 1.419 . . . . 0.0 112.835 176.872 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tp -98.88 -12.02 21.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.956 1.702 . . . . 0.0 113.544 -173.064 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.76 55.62 4.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.116 1.367 . . . . 0.0 112.643 176.218 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 10.1 pt -123.23 163.98 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 126.971 2.108 . . . . 0.0 110.731 174.913 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 58.8 m -57.88 139.44 54.2 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.711 1.204 . . . . 0.0 110.394 163.149 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -61.22 -33.82 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 O-C-N 121.116 -0.99 . . . . 0.0 111.642 -179.547 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -72.76 -31.98 65.29 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.34 -0.85 . . . . 0.0 112.946 176.281 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.27 -39.56 94.92 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.683 167.121 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.18 -49.78 72.91 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.147 0.885 . . . . 0.0 110.896 178.745 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -33.95 73.38 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -179.737 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -86.12 -40.52 15.6 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.348 0.976 . . . . 0.0 112.825 175.689 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.45 -37.39 75.33 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.974 1.31 . . . . 0.0 113.056 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.3 mt -49.05 -39.8 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.953 1.301 . . . . 0.0 111.708 171.785 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -90.25 -32.5 16.53 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.718 1.207 . . . . 0.0 113.531 178.333 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 m120 . . . . . 0 CA--C 1.543 0.703 0 CA-C-N 118.688 0.676 . . . . 0.0 111.842 -176.633 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 62.4 p . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 61.29 19.36 10.07 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.836 1.654 . . . . 0.0 113.451 -176.045 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -82.08 -13.22 57.61 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.583 1.953 . . . . 0.0 113.974 -178.483 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -74.17 14.71 0.39 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.642 1.977 . . . . 0.0 114.83 -172.097 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -80.24 -19.12 47.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.397 1.479 . . . . 0.0 112.974 -170.79 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.3 m -122.72 -39.07 2.56 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.599 1.96 . . . . 0.0 111.477 -172.834 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.4 mt -67.27 158.82 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.559 1.144 . . . . 0.0 108.415 165.131 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.6 ttmm 67.51 -10.58 0.35 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 167.644 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.3 ptt? -83.6 -26.37 30.06 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.113 0.869 . . . . 0.0 113.162 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 p90 -121.57 -10.83 8.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.844 1.258 . . . . 0.0 114.359 -175.172 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 . . . . . 0 CA--C 1.541 0.599 0 C-N-CA 124.64 1.176 . . . . 0.0 111.788 -176.871 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.524 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 58.9 p -149.5 160.01 43.82 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.487 1.515 . . . . 0.0 112.117 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 32.8 t60 -101.01 123.95 45.98 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.39 1.076 . . . . 0.0 110.97 175.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 90.8 mtp -134.49 110.96 9.72 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.002 1.321 . . . . 0.0 109.923 177.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -134.49 -58.41 0.83 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.059 1.343 . . . . 0.0 112.189 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.4 m 51.03 32.28 7.41 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 174.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 mmt -146.46 -44.86 0.19 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.369 1.867 . . . . 0.0 112.371 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -88.4 0.1 56.6 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.472 1.509 . . . . 0.0 112.891 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.24 28.23 1.7 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.551 1.14 . . . . 0.0 113.297 -164.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -100.87 69.59 1.35 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.954 1.301 . . . . 0.0 110.771 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -139.44 -50.19 0.5 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.212 1.005 . . . . 0.0 113.288 177.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -126.65 122.71 35.76 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.164 1.386 . . . . 0.0 109.568 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.9 mm -133.48 122.2 43.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.604 1.562 . . . . 0.0 108.928 -171.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.5 tt -149.06 147.3 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 124.95 1.3 . . . . 0.0 111.646 -174.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -102.63 -27.79 12.53 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -173.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -142.62 137.69 30.2 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.886 1.274 . . . . 0.0 111.709 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 25.7 pt -133.14 4.95 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.671 1.188 . . . . 0.0 114.189 -174.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -144.84 165.98 26.55 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.485 1.514 . . . . 0.0 112.38 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -82.6 12.66 4.39 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.01 1.724 . . . . 0.0 114.97 -172.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -138.42 152.01 47.98 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 126.911 2.084 . . . . 0.0 110.755 178.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -147.87 -82.97 0.12 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.601 1.16 . . . . 0.0 111.94 175.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.2 mp -127.73 6.42 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 126.485 1.914 . . . . 0.0 112.199 -176.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -92.88 2.46 56.76 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.634 -1.291 . . . . 0.0 114.003 -171.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -125.79 -44.78 1.78 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.847 1.259 . . . . 0.0 112.898 -174.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -71.29 -26.97 63.09 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.004 1.321 . . . . 0.0 114.501 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.5 t -90.25 -31.27 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 125.022 1.329 . . . . 0.0 111.544 175.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.0 t -132.04 85.47 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 125.202 1.401 . . . . 0.0 110.204 -175.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.6 tp -110.41 138.02 47.34 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.861 1.264 . . . . 0.0 111.897 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -137.4 38.62 2.48 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.024 1.73 . . . . 0.0 112.586 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -128.07 56.16 19.92 Favored Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 124.686 1.195 . . . . 0.0 113.341 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -77.39 74.64 5.02 Favored 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 123.749 2.966 . . . . 0.0 111.598 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 34.8 mmt-85 -124.6 -54.3 1.66 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.02 1.328 . . . . 0.0 113.82 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.8 t -136.75 88.86 18.45 Favored Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 124.426 1.09 . . . . 0.0 110.599 -173.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.09 155.77 26.05 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.729 2.286 . . . . 0.0 113.317 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.1 p -85.92 56.07 3.81 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 127.461 2.304 . . . . 0.0 113.652 -171.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -83.51 16.88 2.39 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -171.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -90.99 69.37 6.29 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.984 1.714 . . . . 0.0 111.837 -166.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.4 t -132.34 34.84 3.71 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.118 1.367 . . . . 0.0 113.25 -172.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.75 45.72 9.13 Favored Glycine 0 CA--C 1.535 1.309 0 O-C-N 120.763 -1.211 . . . . 0.0 113.474 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -99.47 35.99 1.85 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.307 1.843 . . . . 0.0 112.599 -168.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 64.27 99.26 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 128.076 2.551 . . . . 0.0 113.752 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.9 m -93.17 -73.13 0.57 Allowed 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.186 -0.946 . . . . 0.0 113.061 -168.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -162.61 -45.68 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.939 0.496 . . . . 0.0 111.432 -174.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.77 -33.89 76.61 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.641 0.777 . . . . 0.0 110.577 174.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.0 -38.75 83.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.602 1.161 . . . . 0.0 111.375 -176.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -64.89 -37.76 88.7 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 172.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -66.12 -2.42 4.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 171.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.6 mt -105.21 -53.29 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.104 1.362 . . . . 0.0 110.432 165.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.3 t -69.96 -64.06 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.059 0.845 . . . . 0.0 111.817 -173.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.62 -30.74 68.55 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 111.704 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -55.87 -36.93 68.14 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 166.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.34 -37.9 60.45 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.241 1.016 . . . . 0.0 112.311 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mm -61.5 -30.96 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 121.044 -1.035 . . . . 0.0 110.501 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 t -72.81 -17.0 61.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.91 1.284 . . . . 0.0 114.286 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -101.38 -42.66 6.2 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.601 -1.312 . . . . 0.0 112.745 -169.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.6 m -129.04 -13.31 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -169.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.88 -78.26 0.38 Allowed Glycine 0 N--CA 1.47 0.915 0 C-N-CA 125.187 1.375 . . . . 0.0 112.198 165.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tp -160.6 -45.87 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.592 1.157 . . . . 0.0 112.287 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -109.74 -8.28 14.95 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.801 1.64 . . . . 0.0 114.28 -167.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -88.72 -14.29 37.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.873 0.869 . . . . 0.0 112.852 -175.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -66.52 166.67 12.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.724 1.21 . . . . 0.0 112.082 164.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -119.09 165.16 14.5 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 122.427 1.108 . . . . 0.0 111.716 170.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.89 -26.78 59.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.551 1.14 . . . . 0.0 112.679 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -65.38 -46.06 81.56 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 112.123 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -67.37 -27.92 67.52 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.578 -1.326 . . . . 0.0 113.088 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.37 -56.92 6.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.201 1.0 . . . . 0.0 111.695 167.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.2 p -60.3 -26.68 66.7 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.565 1.146 . . . . 0.0 113.703 -177.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -70.37 -27.41 64.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.12 1.368 . . . . 0.0 113.74 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -114.08 -31.57 6.31 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.753 1.221 . . . . 0.0 113.454 -174.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.3 mt -84.69 -19.03 33.45 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.413 1.485 . . . . 0.0 112.723 173.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.53 22.38 12.09 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 126.166 1.786 . . . . 0.0 114.164 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.5 pt -73.64 164.84 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.963 1.705 . . . . 0.0 110.538 163.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 70' ' ' LYS . 15.3 t -76.34 156.8 33.01 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.512 -0.742 . . . . 0.0 110.946 166.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.09 -38.37 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.01 0.924 . . . . 0.0 111.487 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -70.08 -31.39 68.96 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.405 ' H ' HG23 ' A' ' 67' ' ' THR . 77.6 mttt -67.93 -36.67 80.55 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.076 168.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.05 -47.33 71.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.445 1.02 . . . . 0.0 111.196 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.9 mtpt -55.3 -43.38 74.77 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.536 1.534 . . . . 0.0 112.631 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -82.5 -38.23 24.14 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.8 -39.3 73.88 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.866 -1.146 . . . . 0.0 112.59 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.9 mt -48.94 -65.98 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.338 1.455 . . . . 0.0 110.453 173.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -64.91 -27.14 68.65 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -73.35 -36.67 66.17 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.463 1.029 . . . . 0.0 112.841 -177.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.7 m -80.05 -39.13 30.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.953 0.901 . . . . 0.0 112.899 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.81 88.75 1.63 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.379 1.072 . . . . 0.0 111.458 -175.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -73.81 -42.96 60.2 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.049 0.94 . . . . 0.0 113.299 178.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 24.5 mmt -102.62 -19.93 14.63 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.214 1.406 . . . . 0.0 113.576 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.63 133.76 4.66 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.299 0.952 . . . . 0.0 110.865 -168.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 46.84 36.05 3.64 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.643 1.577 . . . . 0.0 113.665 -177.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 47.43 33.25 2.67 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 127.382 2.273 . . . . 0.0 113.768 -176.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.4 4.93 0.38 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.688 1.995 . . . . 0.0 115.575 -172.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.57 -10.84 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 120.145 -1.597 . . . . 0.0 113.647 -173.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -68.03 9.25 0.32 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.12 2.168 . . . . 0.0 115.352 -176.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -92.01 -6.0 51.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 128.611 2.764 . . . . 0.0 114.234 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.2 m -141.47 -45.66 0.37 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.138 1.775 . . . . 0.0 110.489 -170.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.0 pt -64.09 168.12 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 123.689 0.796 . . . . 0.0 111.193 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? 69.06 -14.94 0.28 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 126.694 1.998 . . . . 0.0 116.241 -177.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.39 19.72 2.39 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 120.414 1.461 . . . . 0.0 114.777 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -142.94 -24.58 0.62 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.169 1.544 . . . . 0.0 115.169 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -83.13 130.17 35.09 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.228 -0.92 . . . . 0.0 111.728 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -147.58 155.35 41.75 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.671 1.588 . . . . 0.0 111.61 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -74.85 145.56 42.69 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.049 0.94 . . . . 0.0 112.007 172.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.4 t -123.2 -47.11 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 124.734 1.214 . . . . 0.0 111.512 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.2 m -125.82 25.98 6.74 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.378 1.471 . . . . 0.0 112.685 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . 0.256 85.8 p 47.92 35.02 4.45 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.0 2.12 . . . . 0.0 115.348 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -138.44 158.02 45.07 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.08 1.752 . . . . 0.0 112.292 -176.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 69.1 m -144.67 141.1 29.08 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.422 1.489 . . . . 0.0 110.689 -175.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.85 15.5 1.15 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.889 1.676 . . . . 0.0 115.367 -175.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.1 mm-40 -82.03 153.3 69.45 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.889 1.276 . . . . 0.0 111.707 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.71 115.0 3.16 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.11 2.54 . . . . 0.0 111.224 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -139.88 91.68 2.49 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.877 1.671 . . . . 0.0 109.6 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.55 91.0 35.58 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.08 1.352 . . . . 0.0 109.518 -175.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 C--O 1.253 1.236 0 C-N-CA 123.963 3.109 . . . . 0.0 113.4 -176.237 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.504 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 52.3 m -120.24 151.81 38.64 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.258 1.423 . . . . 0.0 112.132 -178.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -111.37 32.84 5.06 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.241 1.416 . . . . 0.0 112.896 -172.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 67.0 mtt -86.38 79.12 9.12 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.166 1.386 . . . . 0.0 110.869 -176.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -122.1 -70.92 0.75 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.931 1.293 . . . . 0.0 112.549 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 16.6 m 53.26 25.38 4.36 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 117.056 2.243 . . . . 0.0 117.056 171.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.7 mtm -146.8 -33.17 0.3 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.839 1.256 . . . . 0.0 114.316 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -94.66 -2.41 51.33 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.663 1.585 . . . . 0.0 113.143 -174.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.44 38.08 1.25 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.101 1.36 . . . . 0.0 112.038 -162.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.8 mp -104.73 40.2 1.54 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.505 1.522 . . . . 0.0 112.037 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -143.05 99.48 3.46 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.829 1.652 . . . . 0.0 107.927 174.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -83.42 106.63 15.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.549 1.14 . . . . 0.0 111.107 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.6 mp -98.78 75.32 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.018 0.927 . . . . 0.0 111.091 -171.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.6 tt -147.97 150.24 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.514 1.126 . . . . 0.0 111.971 175.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -147.56 -38.34 0.2 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.697 1.199 . . . . 0.0 112.613 175.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.411 ' HG2' ' H ' ' A' ' 11' ' ' ILE . 9.6 tt0 -138.57 179.54 6.41 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.642 1.577 . . . . 0.0 111.201 175.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.411 ' H ' ' HG2' ' A' ' 10' ' ' GLN . 16.4 tt -118.06 122.88 70.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 127.555 2.342 . . . . 0.0 109.865 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -161.2 174.12 14.08 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.755 2.422 . . . . 0.0 111.098 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -71.9 85.78 0.97 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.683 1.593 . . . . 0.0 110.568 174.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -72.15 31.91 0.06 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 128.4 2.68 . . . . 0.0 116.921 -169.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.22 -11.15 37.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 116.896 2.184 . . . . 0.0 116.896 -166.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.6 mt -78.71 -14.62 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.726 1.61 . . . . 0.0 114.126 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -74.66 -12.14 60.36 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.001 1.111 . . . . 0.0 114.001 -173.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.7 m -85.45 -26.89 26.07 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -96.91 -13.75 22.22 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -174.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.2 t -72.5 -31.33 37.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.512 1.125 . . . . 0.0 111.476 177.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.3 t -92.8 68.54 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.068 1.347 . . . . 0.0 110.739 -176.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.3 tp -129.31 151.13 50.3 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.292 1.437 . . . . 0.0 111.92 173.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -83.56 23.84 0.91 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.332 1.853 . . . . 0.0 114.326 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -34.57 99.12 0.16 Allowed Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 128.491 2.717 . . . . 0.0 114.359 -171.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -97.94 68.89 0.09 OUTLIER 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 122.804 2.336 . . . . 0.0 112.222 -164.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 mtp-105 -124.5 -38.33 2.42 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.8 t -123.79 84.88 53.86 Favored Pre-proline 0 N--CA 1.48 1.067 0 C-N-CA 124.729 1.211 . . . . 0.0 110.639 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -76.79 171.62 17.66 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.45 2.767 . . . . 0.0 112.949 174.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.1 p -113.89 64.02 0.66 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.651 1.98 . . . . 0.0 112.737 -170.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -75.66 31.44 0.11 Allowed 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 115.954 1.835 . . . . 0.0 115.954 -175.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt -83.12 72.31 10.13 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.199 1.4 . . . . 0.0 111.279 -173.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.6 t -129.56 26.58 5.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.447 1.499 . . . . 0.0 113.22 -170.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.95 16.64 5.27 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 125.909 1.719 . . . . 0.0 114.912 178.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -105.03 30.89 5.2 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.714 2.006 . . . . 0.0 112.352 -175.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 tp 57.81 79.1 0.21 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.597 2.359 . . . . 0.0 113.908 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.1 m -95.5 -69.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.284 . . . . 0.0 112.729 -168.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -161.72 -43.42 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -172.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -73.4 -26.05 60.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.139 0.576 . . . . 0.0 110.59 175.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 -69.73 -41.57 75.13 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.357 1.463 . . . . 0.0 110.391 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -62.47 -36.27 81.94 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.807 0.843 . . . . 0.0 112.834 168.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -65.37 -3.97 4.91 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.6 mt -109.29 -20.59 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.834 1.654 . . . . 0.0 112.393 173.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.6 t -122.89 -53.88 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 CA-C-N 119.463 1.028 . . . . 0.0 113.634 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.83 -33.34 73.97 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.616 1.098 . . . . 0.0 110.948 171.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.76 -43.88 97.42 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.874 0.87 . . . . 0.0 113.055 167.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -36.24 78.16 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.624 1.17 . . . . 0.0 112.131 -178.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.95 -24.62 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 124.883 1.273 . . . . 0.0 111.649 171.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -80.56 -16.86 53.16 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.025 1.121 . . . . 0.0 114.025 171.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -94.82 -50.65 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.668 -1.27 . . . . 0.0 112.009 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 m -123.53 -13.84 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -167.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 124.2 -75.42 0.39 Allowed Glycine 0 N--CA 1.469 0.888 0 C-N-CA 125.328 1.442 . . . . 0.0 112.913 163.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.5 tp -166.78 -40.74 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.437 1.495 . . . . 0.0 112.206 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -111.05 -5.19 14.84 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -168.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -93.48 -17.99 22.8 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.101 0.961 . . . . 0.0 112.99 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -68.29 163.82 22.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.782 1.233 . . . . 0.0 112.096 165.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -116.78 169.75 9.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 122.454 1.121 . . . . 0.0 111.645 172.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.03 -24.44 40.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.308 1.043 . . . . 0.0 112.651 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.0 m -65.26 -45.3 85.06 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.802 1.641 . . . . 0.0 112.292 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.94 -38.23 90.28 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.517 -1.365 . . . . 0.0 111.931 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.3 -51.09 71.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.5 0.72 . . . . 0.0 112.167 172.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.5 p -65.51 -31.11 71.99 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.699 0.799 . . . . 0.0 113.116 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -70.87 -41.71 71.04 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.29 1.436 . . . . 0.0 112.602 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -96.19 -35.14 11.4 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.484 1.113 . . . . 0.0 113.416 -169.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 tt -91.64 -17.29 25.75 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.14 1.776 . . . . 0.0 112.099 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 61.01 69.96 0.64 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.212 1.805 . . . . 0.0 112.712 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.9 pt -136.79 162.89 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 128.384 2.674 . . . . 0.0 109.136 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -70.15 152.53 44.19 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.382 -0.824 . . . . 0.0 111.038 167.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 t -58.92 -36.07 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.052 0.941 . . . . 0.0 111.379 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.84 -32.26 71.82 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -69.14 -35.52 76.46 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.592 -0.718 . . . . 0.0 111.117 171.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.25 -49.74 63.23 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.767 0.712 . . . . 0.0 110.568 175.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -54.11 -42.91 69.94 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.506 1.522 . . . . 0.0 112.563 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -87.02 -32.18 20.15 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -63.04 -37.77 88.51 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.505 -1.372 . . . . 0.0 112.25 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.6 mt -49.79 -44.77 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.624 1.17 . . . . 0.0 111.739 175.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -90.0 -25.2 20.98 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -73.95 -27.22 60.9 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.848 1.204 . . . . 0.0 112.627 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.7 t -83.49 -39.03 21.03 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.193 0.997 . . . . 0.0 113.516 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -111.31 -32.47 6.73 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -171.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 48.26 53.0 12.51 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 127.736 2.414 . . . . 0.0 114.175 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.6 mmm 64.29 -32.19 0.13 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 128.488 2.715 . . . . 0.0 115.655 -175.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 138.58 -34.29 2.12 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 126.354 1.93 . . . . 0.0 113.101 167.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -127.01 17.55 7.24 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.203 1.801 . . . . 0.0 113.216 175.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m 52.15 33.3 12.03 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.415 1.486 . . . . 0.0 112.297 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 m120 52.61 30.8 9.12 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.514 1.526 . . . . 0.0 114.739 -175.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.94 -1.01 38.31 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -68.7 13.75 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.628 1.971 . . . . 0.0 115.758 -175.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.7 pttt -91.65 -6.54 51.97 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.075 2.55 . . . . 0.0 114.318 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 90.0 m -136.93 -42.09 0.59 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.808 1.643 . . . . 0.0 111.393 -173.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.7 pt -69.42 169.43 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 123.738 0.815 . . . . 0.0 111.384 170.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 67.53 -29.17 0.15 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.199 2.199 . . . . 0.0 115.791 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.2 ptp -94.29 -34.89 12.67 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.648 1.179 . . . . 0.0 113.606 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -90.0 -25.67 20.74 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 173.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.45 131.98 14.79 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.162 0.985 . . . . 0.0 111.924 -173.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -159.39 65.49 0.39 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.011 1.324 . . . . 0.0 110.985 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -129.4 139.87 51.52 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.176 1.391 . . . . 0.0 111.738 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.5 t -133.42 -47.97 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 124.368 1.067 . . . . 0.0 112.698 -176.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.9 t -129.2 24.56 5.55 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.928 1.291 . . . . 0.0 112.487 -178.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.5 p 53.86 176.04 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 128.123 2.569 . . . . 0.0 115.283 -169.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -148.01 116.29 6.55 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.366 1.067 . . . . 0.0 111.544 177.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.0 m -141.53 121.14 13.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.614 1.566 . . . . 0.0 110.081 175.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.01 16.17 2.07 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.2 1.8 . . . . 0.0 115.77 -175.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -86.79 148.14 45.14 Favored Pre-proline 0 CA--C 1.544 0.736 0 C-N-CA 124.901 1.28 . . . . 0.0 111.987 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.82 120.52 7.43 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.283 2.656 . . . . 0.0 110.482 172.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -133.21 80.73 1.9 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.196 1.398 . . . . 0.0 110.189 -177.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -150.18 151.04 30.95 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 126.128 1.771 . . . . 0.0 111.745 -175.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo . . . . . 0 C--O 1.253 1.228 0 C-N-CA 123.814 3.009 . . . . 0.0 113.234 177.634 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.566 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 31.8 p -72.98 149.87 42.95 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.214 1.006 . . . . 0.0 112.875 176.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -149.63 133.65 17.11 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.877 1.271 . . . . 0.0 110.362 175.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 23.7 mmt -127.35 94.16 3.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.645 1.178 . . . . 0.0 110.839 -176.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -148.49 -54.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.251 1.42 . . . . 0.0 112.015 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 54.1 24.83 5.08 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 126.153 1.781 . . . . 0.0 115.485 177.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.4 mtt -143.91 -33.28 0.42 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.468 1.507 . . . . 0.0 113.906 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -95.97 -1.85 48.23 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.439 1.496 . . . . 0.0 112.377 172.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -149.4 60.03 1.02 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.554 1.542 . . . . 0.0 110.546 -166.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -142.88 148.22 36.63 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.864 1.265 . . . . 0.0 112.174 167.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -146.75 -54.75 0.25 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.565 1.146 . . . . 0.0 112.534 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -116.58 114.7 24.49 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.251 1.421 . . . . 0.0 110.216 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.3 mm -129.89 110.46 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.694 1.598 . . . . 0.0 108.309 -177.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.7 tt -142.72 9.9 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 124.364 1.066 . . . . 0.0 113.753 -172.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -101.12 107.97 19.53 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.803 -1.186 . . . . 0.0 110.882 177.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -158.29 -53.85 0.07 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.671 1.188 . . . . 0.0 111.943 174.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.8 pt -144.39 111.48 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 126.746 2.019 . . . . 0.0 109.515 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -159.1 150.28 20.16 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.667 1.187 . . . . 0.0 110.925 -176.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -80.95 77.85 7.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.068 0.947 . . . . 0.0 110.598 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.62 33.45 0.07 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 -174.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.55 -72.31 0.25 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.44 1.896 . . . . 0.0 113.347 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 66.3 mt -123.81 -7.88 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.596 1.558 . . . . 0.0 112.985 -173.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -72.03 -12.71 61.35 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -172.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.5 t -93.98 -56.34 2.9 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.357 1.063 . . . . 0.0 112.499 173.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -71.64 -14.06 61.94 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -170.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.2 p -69.87 -23.18 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.274 1.03 . . . . 0.0 112.47 174.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.6 t -91.63 59.11 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 125.343 1.457 . . . . 0.0 110.699 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 22.5 mt -137.2 132.11 33.42 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.355 1.462 . . . . 0.0 112.099 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -135.7 19.94 3.3 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 126.418 1.887 . . . . 0.0 113.633 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -125.73 49.57 3.71 Favored Pre-proline 0 CA--C 1.559 1.324 0 C-N-CA 125.334 1.454 . . . . 0.0 113.751 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -80.15 66.73 8.78 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.568 2.845 . . . . 0.0 113.007 -174.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 73.6 mtt85 -112.76 -42.8 3.54 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.129 1.372 . . . . 0.0 114.354 -177.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.2 t 37.9 80.21 0.28 Allowed Pre-proline 0 N--CA 1.48 1.045 0 C-N-CA 128.113 2.565 . . . . 0.0 113.59 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.51 165.82 27.86 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.862 2.375 . . . . 0.0 113.95 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.7 p -119.73 61.88 0.83 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.627 1.571 . . . . 0.0 112.964 -157.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -99.42 18.57 17.45 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -169.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.24 27.09 0.26 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.988 2.115 . . . . 0.0 113.865 -172.322 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -145.2 14.53 1.47 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.821 1.248 . . . . 0.0 114.02 -164.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.7 37.27 0.72 Allowed Glycine 0 N--CA 1.475 1.297 0 O-C-N 120.626 -1.297 . . . . 0.0 114.209 -175.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -105.94 17.25 23.93 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -167.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp -129.75 137.65 50.66 Favored 'General case' 0 C--N 1.343 0.287 0 C-N-CA 126.087 1.755 . . . . 0.0 109.444 176.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.9 m -114.46 -73.25 0.66 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.904 1.682 . . . . 0.0 112.855 -176.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -160.17 -32.38 0.06 Allowed 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -170.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -83.15 -27.43 30.1 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.909 0.484 . . . . 0.0 111.226 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -75.4 -42.81 52.86 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.815 1.246 . . . . 0.0 111.437 -169.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -70.8 -26.69 63.43 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.995 0.918 . . . . 0.0 112.61 174.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -66.54 -4.71 9.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 166.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.1 mt -107.09 -52.83 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.14 1.376 . . . . 0.0 110.258 166.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.82 -57.85 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.231 0.923 . . . . 0.0 111.581 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.64 67.82 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.366 0.53 . . . . 0.0 111.777 -177.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -57.85 -36.92 72.97 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 167.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -38.19 70.34 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.195 0.998 . . . . 0.0 111.852 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -58.81 -35.01 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 O-C-N 120.24 -1.538 . . . . 0.0 110.749 174.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.2 m -77.15 -4.94 47.13 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -107.26 -29.94 9.02 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.936 1.244 . . . . 0.0 113.436 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.3 p -136.21 -22.22 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 -171.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 140.05 -86.31 0.21 Allowed Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.663 1.125 . . . . 0.0 111.801 174.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.424 HD11 ' ND2' ' A' ' 79' ' ' ASN . 45.5 tp -159.54 -42.98 0.05 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.844 1.258 . . . . 0.0 112.397 174.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -117.3 2.92 12.58 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -168.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -94.95 -17.04 22.33 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.295 0.638 . . . . 0.0 112.281 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.98 161.73 18.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.122 1.369 . . . . 0.0 112.087 168.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -110.78 162.3 14.91 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.564 1.173 . . . . 0.0 111.557 168.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.81 -24.94 48.64 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.614 1.166 . . . . 0.0 112.584 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.2 m -64.02 -47.17 81.31 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.907 1.683 . . . . 0.0 111.731 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -62.59 -40.47 97.01 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.753 1.221 . . . . 0.0 113.074 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.51 -51.53 69.07 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.051 0.94 . . . . 0.0 111.278 168.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.1 m -58.76 -30.38 67.48 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.341 1.456 . . . . 0.0 113.167 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -79.4 -18.52 52.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.554 1.542 . . . . 0.0 113.511 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -110.04 -36.66 5.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.194 1.398 . . . . 0.0 113.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.24 -19.57 46.58 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.364 1.066 . . . . 0.0 112.663 171.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.12 63.12 1.48 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.175 1.39 . . . . 0.0 111.366 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.6 pt -128.34 167.28 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.544 1.938 . . . . 0.0 111.947 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.1 m -65.06 134.53 54.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.954 1.702 . . . . 0.0 109.551 165.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.77 -34.37 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 122.992 0.517 . . . . 0.0 111.742 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.2 -28.76 66.66 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 177.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -68.87 -36.95 78.72 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.272 170.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.62 -49.08 61.98 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.704 0.684 . . . . 0.0 110.437 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -53.31 -42.63 66.87 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.119 1.368 . . . . 0.0 112.594 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -87.79 -32.63 18.98 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -62.62 -38.96 92.27 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.179 -0.951 . . . . 0.0 112.228 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.6 mt -48.06 -65.6 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.013 1.325 . . . . 0.0 109.851 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.76 -28.64 67.79 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 -77.54 -28.68 51.96 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 120.027 1.285 . . . . 0.0 113.152 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.0 t -79.56 -44.15 21.66 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.945 0.898 . . . . 0.0 111.902 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.424 ' ND2' HD11 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -150.54 87.13 1.42 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.252 1.421 . . . . 0.0 111.117 -176.441 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 64.9 ttt-85 -70.94 -44.16 66.66 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.634 1.174 . . . . 0.0 113.149 176.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 92.1 mtp -125.51 -21.32 4.53 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.69 1.596 . . . . 0.0 113.055 -176.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 108.98 -27.18 13.34 Favored Glycine 0 N--CA 1.476 1.318 0 C-N-CA 125.569 1.557 . . . . 0.0 115.019 166.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 58.6 mtt85 -122.25 28.97 7.2 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 126.306 1.842 . . . . 0.0 112.759 172.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.5 m 50.44 32.75 6.83 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.668 1.987 . . . . 0.0 113.145 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.259 0.8 OUTLIER 46.11 26.67 0.45 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.765 2.026 . . . . 0.0 115.977 -170.589 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -8.28 25.42 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.719 1.208 . . . . 0.0 114.155 -175.159 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -72.83 15.52 0.19 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.442 1.897 . . . . 0.0 115.058 -174.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -89.32 -5.13 57.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.093 2.557 . . . . 0.0 114.726 -169.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 93.8 m -138.19 -50.47 0.58 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.206 1.802 . . . . 0.0 109.954 -171.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.2 pt -66.9 165.08 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.813 1.245 . . . . 0.0 112.279 172.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.57 -7.2 0.19 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.452 2.301 . . . . 0.0 116.018 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 47.3 mtm -93.23 -44.1 8.5 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.875 1.216 . . . . 0.0 113.518 -178.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -109.85 -6.05 15.35 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -76.46 159.34 30.5 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.052 1.341 . . . . 0.0 112.289 177.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -76.02 123.42 25.72 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.469 -0.769 . . . . 0.0 111.258 174.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -140.62 146.81 38.44 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.989 1.716 . . . . 0.0 110.399 175.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.3 t -122.93 -44.02 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.587 1.155 . . . . 0.0 111.217 -174.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 74.8 p -113.54 2.31 15.3 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.633 1.573 . . . . 0.0 114.267 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 t -138.02 26.06 2.73 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.84 1.656 . . . . 0.0 113.172 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.4 169.35 18.48 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.805 1.242 . . . . 0.0 112.649 176.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.6 t -129.62 165.67 21.31 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.388 1.475 . . . . 0.0 111.788 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -78.38 28.08 0.2 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.415 1.886 . . . . 0.0 113.944 -175.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 47.52 60.04 15.76 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 127.364 2.266 . . . . 0.0 113.686 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -77.81 57.12 5.93 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 124.963 3.775 . . . . 0.0 112.714 -177.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -136.7 95.0 3.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.662 1.585 . . . . 0.0 109.784 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.5 tp -121.43 91.39 48.29 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 125.525 1.53 . . . . 0.0 110.31 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 C--O 1.253 1.263 0 C-N-CA 123.862 3.041 . . . . 0.0 113.277 -178.974 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.537 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 5.9 t -72.26 164.01 26.99 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.881 0.872 . . . . 0.0 112.463 175.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -139.91 130.73 25.99 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.775 1.23 . . . . 0.0 110.98 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 89.2 mmm -131.23 105.3 7.57 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.405 1.482 . . . . 0.0 111.007 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -142.68 -44.27 0.31 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.843 1.257 . . . . 0.0 112.855 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 32.7 m 55.42 -10.04 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 118.485 2.772 . . . . 0.0 118.485 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.7 mtm -121.2 -9.64 9.09 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.239 1.816 . . . . 0.0 113.793 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -123.77 14.75 9.36 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.149 2.18 . . . . 0.0 111.326 174.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -156.18 8.0 0.22 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.171 1.389 . . . . 0.0 113.158 -149.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 tp -146.03 133.57 20.9 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.676 1.19 . . . . 0.0 111.4 -175.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 54.51 15.07 0.92 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.561 1.944 . . . . 0.0 115.73 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -104.86 83.46 2.01 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.705 1.602 . . . . 0.0 110.936 -177.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.9 mp -123.36 68.72 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.375 1.47 . . . . 0.0 108.545 176.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.1 mt -128.97 137.26 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 126.165 1.786 . . . . 0.0 108.77 -178.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -144.47 157.56 44.18 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.328 1.451 . . . . 0.0 110.749 -177.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -62.14 141.38 58.19 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.505 -0.747 . . . . 0.0 112.362 176.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 33.5 pt -138.08 133.08 43.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 126.575 1.95 . . . . 0.0 109.971 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -133.33 -78.29 0.48 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.8 1.64 . . . . 0.0 109.97 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -152.36 25.12 0.61 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.497 1.919 . . . . 0.0 112.487 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -70.39 -30.31 67.17 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.754 -1.217 . . . . 0.0 112.836 -175.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 48.92 29.37 2.31 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.728 1.611 . . . . 0.0 113.777 -172.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . 0.281 5.2 mp 61.23 7.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 127.088 2.155 . . . . 0.0 114.073 -174.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.67 -19.58 61.4 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.102 -1.624 . . . . 0.0 113.555 -170.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 51.0 m -97.18 -46.1 6.27 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.432 0.693 . . . . 0.0 112.23 -173.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -74.76 -13.45 60.59 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 91.7 t -94.84 -30.51 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.04 1.336 . . . . 0.0 112.228 174.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.1 t -129.53 87.8 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.86 1.264 . . . . 0.0 109.974 -177.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -137.8 131.75 31.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.169 1.388 . . . . 0.0 111.32 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.0 mttm -139.85 15.17 2.49 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -135.44 74.55 60.17 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 124.887 1.275 . . . . 0.0 112.664 -176.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -81.24 64.48 8.79 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.752 2.968 . . . . 0.0 112.364 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.9 mtt-85 -131.79 -55.64 1.0 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.366 1.466 . . . . 0.0 114.031 -176.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.0 t 41.7 64.96 5.09 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 127.263 2.225 . . . . 0.0 113.267 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.48 158.34 40.37 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.036 2.491 . . . . 0.0 113.838 -174.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.4 p -78.46 59.81 2.48 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 128.307 2.643 . . . . 0.0 113.76 -174.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -82.84 22.54 0.91 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.195 1.798 . . . . 0.0 115.736 -172.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -87.26 65.04 8.61 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.714 2.006 . . . . 0.0 112.37 -168.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.4 t -150.63 11.06 0.66 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -165.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -147.87 32.06 1.32 Allowed Glycine 0 N--CA 1.476 1.331 0 O-C-N 120.544 -1.347 . . . . 0.0 115.517 -169.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -76.98 -50.4 13.26 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.383 1.091 . . . . 0.0 113.927 -169.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.6 mp -142.18 133.8 26.81 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.344 1.858 . . . . 0.0 110.329 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 p -95.75 -87.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.657 1.983 . . . . 0.0 111.722 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -159.34 -36.96 0.06 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.494 1.118 . . . . 0.0 112.567 -172.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.44 -33.26 73.88 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.755 0.822 . . . . 0.0 110.471 168.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -72.23 -31.31 65.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.455 1.102 . . . . 0.0 111.404 -175.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -42.49 99.38 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.291 1.036 . . . . 0.0 113.722 165.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -60.42 -9.38 3.54 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 172.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.5 mt -99.26 -57.27 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.14 1.376 . . . . 0.0 111.153 166.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.29 -55.63 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 119.573 1.078 . . . . 0.0 112.8 -172.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.04 -32.67 74.5 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.674 -0.641 . . . . 0.0 111.056 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.76 -34.26 76.86 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -36.5 63.72 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.563 1.145 . . . . 0.0 111.703 174.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.89 -33.82 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.138 -1.601 . . . . 0.0 110.389 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.1 m -79.75 -3.54 48.01 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 170.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -101.27 -40.39 7.16 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.996 1.271 . . . . 0.0 112.501 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 p -132.98 -22.8 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 -169.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 142.98 -84.9 0.19 Allowed Glycine 0 N--CA 1.469 0.883 0 C-N-CA 124.559 1.076 . . . . 0.0 111.517 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -165.6 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 111.302 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -104.85 -9.31 18.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.591 1.556 . . . . 0.0 114.771 -166.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -92.17 -16.95 25.57 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.66 0.664 . . . . 0.0 112.713 -174.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.93 161.21 18.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.334 1.454 . . . . 0.0 114.521 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.1 t-20 -100.95 123.4 45.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.011 1.324 . . . . 0.0 110.948 -177.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.55 -28.84 70.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.673 1.189 . . . . 0.0 113.022 177.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.2 m -68.33 -42.63 79.03 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.555 0.742 . . . . 0.0 111.671 176.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -62.2 -37.83 86.82 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.37 -0.831 . . . . 0.0 112.382 175.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.38 -47.37 84.45 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.692 -0.63 . . . . 0.0 111.868 168.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -60.28 -27.16 67.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -76.0 -26.65 56.93 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.252 1.821 . . . . 0.0 112.941 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -105.18 -37.62 6.84 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.367 1.467 . . . . 0.0 112.885 -177.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -17.14 53.31 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.417 1.087 . . . . 0.0 112.453 173.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 59.49 60.23 2.35 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.205 1.402 . . . . 0.0 112.079 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.6 pt -128.76 175.76 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 127.971 2.509 . . . . 0.0 109.645 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.498 HG23 ' H ' ' A' ' 70' ' ' LYS . 10.1 t -77.09 148.64 35.97 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.407 -0.808 . . . . 0.0 110.675 163.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.93 -29.78 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.37 1.068 . . . . 0.0 111.153 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -70.63 -29.65 66.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.498 ' H ' HG23 ' A' ' 67' ' ' THR . 91.0 mttt -73.87 -37.13 64.84 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.818 -0.61 . . . . 0.0 111.183 167.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.88 -47.07 76.06 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.425 0.557 . . . . 0.0 111.006 -177.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 53.8 pttt -70.6 -20.49 62.76 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -176.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -93.41 -39.27 11.01 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.085 0.857 . . . . 0.0 112.336 171.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.69 -42.57 75.39 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.139 -0.976 . . . . 0.0 112.292 177.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mt -47.39 -63.98 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.699 1.2 . . . . 0.0 110.455 175.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.3 pttt -73.37 -32.52 64.55 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -76.2 -34.59 59.28 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.801 0.728 . . . . 0.0 112.295 -177.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.2 t -85.31 -48.96 8.56 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.623 0.769 . . . . 0.0 112.665 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -115.41 85.34 2.25 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.477 1.111 . . . . 0.0 112.721 -178.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.94 -9.56 26.0 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 172.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 65.0 mtt -93.1 -46.35 7.48 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -172.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.76 127.16 3.2 Favored Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.672 1.13 . . . . 0.0 112.14 -174.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 72.8 mmt-85 46.86 33.64 2.28 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 125.628 1.571 . . . . 0.0 113.682 -176.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.1 m 47.15 33.22 2.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.946 2.098 . . . . 0.0 113.524 -174.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.68 31.91 13.62 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 114.3 -174.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.81 -9.26 23.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.778 1.231 . . . . 0.0 113.977 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -75.79 15.88 0.46 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.482 1.913 . . . . 0.0 115.05 -175.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -84.06 9.68 11.92 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.944 2.498 . . . . 0.0 115.165 -170.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -145.62 -46.5 0.21 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.397 1.879 . . . . 0.0 110.054 -168.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.1 mt -74.59 161.83 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.131 1.772 . . . . 0.0 109.289 175.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.72 -9.52 0.18 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 117.086 2.254 . . . . 0.0 117.086 177.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 36.8 mtm -93.12 -32.24 14.51 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -175.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -100.61 -10.79 20.61 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.255 1.022 . . . . 0.0 113.631 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -82.1 42.86 0.75 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 126.092 1.757 . . . . 0.0 113.185 -171.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -80.83 157.86 25.57 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.465 1.506 . . . . 0.0 114.341 -177.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.9 t0 62.25 160.44 0.07 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.592 2.357 . . . . 0.0 115.001 -173.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.3 t -138.8 -42.09 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.517 1.527 . . . . 0.0 111.822 -173.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.3 m -129.34 16.17 6.06 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.905 1.282 . . . . 0.0 113.169 -175.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.0 t 58.37 64.72 1.41 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.053 1.741 . . . . 0.0 113.105 -176.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.81 147.86 46.8 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.157 0.983 . . . . 0.0 112.35 175.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.5 m -138.64 117.35 12.25 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.701 1.2 . . . . 0.0 111.5 -176.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.53 29.9 7.75 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.481 1.513 . . . . 0.0 114.403 -175.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -123.06 149.85 58.03 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 127.067 2.147 . . . . 0.0 111.373 -173.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -80.32 61.12 8.11 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 124.283 3.322 . . . . 0.0 111.662 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 52.44 40.48 29.64 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.85 1.66 . . . . 0.0 112.72 -172.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.1 tt -116.54 100.46 53.45 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.966 1.706 . . . . 0.0 110.012 -170.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo . . . . . 0 C--O 1.253 1.269 0 C-N-CA 124.057 3.171 . . . . 0.0 113.494 -178.071 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.555 0 CA-C-O 121.149 0.305 . . . . 0.0 112.892 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 25.4 p -75.82 133.57 40.59 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.721 1.209 . . . . 0.0 112.85 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -156.09 109.67 2.73 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.612 1.565 . . . . 0.0 109.711 176.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 94.4 mtp -137.5 93.8 2.85 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.874 1.27 . . . . 0.0 110.291 175.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.41 98.35 2.38 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.913 1.285 . . . . 0.0 110.667 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 68.3 p -122.1 4.35 9.84 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.156 1.783 . . . . 0.0 114.607 -174.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 ptp -143.28 -7.99 0.78 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 115.583 1.697 . . . . 0.0 115.583 -168.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -133.21 12.5 4.22 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.279 1.832 . . . . 0.0 112.04 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.26 17.02 1.53 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.072 1.749 . . . . 0.0 112.202 -164.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.1 mp -115.82 75.09 0.93 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.029 1.732 . . . . 0.0 109.677 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -137.12 -4.71 1.9 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -175.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -98.72 86.38 3.53 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.012 1.325 . . . . 0.0 111.106 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.4 mp -130.45 71.86 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.415 1.486 . . . . 0.0 109.27 178.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 36.0 mm -130.62 144.25 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 126.336 1.854 . . . . 0.0 109.779 -177.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -125.92 124.8 41.61 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.858 1.263 . . . . 0.0 110.495 172.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -153.98 -46.15 0.09 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.716 1.206 . . . . 0.0 112.397 178.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.1 tt -153.68 121.93 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 126.74 2.016 . . . . 0.0 109.069 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -138.42 170.59 15.74 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.85 1.66 . . . . 0.0 111.217 -174.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -73.66 73.22 1.49 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.809 1.243 . . . . 0.0 110.374 167.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -73.22 108.25 6.0 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.688 1.195 . . . . 0.0 110.633 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.02 -69.67 0.66 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.45 1.1 . . . . 0.0 112.893 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -122.62 -11.76 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.57 1.148 . . . . 0.0 113.778 -173.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -74.0 -14.48 61.03 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -173.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.6 p -93.04 -63.67 1.19 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.709 1.604 . . . . 0.0 112.173 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -72.12 -10.61 60.02 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -170.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.3 p -74.54 -17.64 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.7 0.8 . . . . 0.0 112.574 172.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.3 t -119.32 75.39 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 125.788 1.635 . . . . 0.0 109.25 174.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.9 tp -139.4 150.63 45.52 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.764 1.225 . . . . 0.0 112.108 -174.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.04 45.6 2.67 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.706 1.602 . . . . 0.0 112.838 -171.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 49.05 72.64 1.19 Allowed Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 126.474 1.91 . . . . 0.0 114.246 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -77.64 61.66 7.55 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 124.311 3.341 . . . . 0.0 111.522 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? 53.38 55.54 8.57 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.275 2.23 . . . . 0.0 113.054 -176.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 32.0 t -114.48 89.16 17.33 Favored Pre-proline 0 N--CA 1.479 1.024 0 C-N-CA 125.194 1.398 . . . . 0.0 110.206 176.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.99 166.24 30.12 Favored 'Trans proline' 0 CA--C 1.534 0.525 0 C-N-CA 123.012 2.475 . . . . 0.0 112.926 171.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 p -127.0 70.88 1.3 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.643 1.577 . . . . 0.0 112.645 -163.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.45 ' H ' ' NE2' ' A' ' 30' ' ' GLN . 2.7 pm0 -95.87 23.25 6.48 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.926 1.691 . . . . 0.0 114.922 -177.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.81 60.86 4.9 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.36 1.864 . . . . 0.0 111.388 -174.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.2 t -141.01 10.9 2.18 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.957 1.303 . . . . 0.0 114.423 -171.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.83 -50.1 31.86 Favored Glycine 0 CA--C 1.535 1.312 0 O-C-N 120.764 -1.21 . . . . 0.0 114.179 -175.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 51.73 33.67 11.52 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.331 1.852 . . . . 0.0 115.057 173.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.0 mp 53.8 89.96 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.442 2.297 . . . . 0.0 113.835 -176.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.4 t -82.01 -73.06 0.41 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.914 0.886 . . . . 0.0 111.899 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -162.87 -36.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.053 0.541 . . . . 0.0 112.306 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -75.25 -33.4 61.29 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.733 0.413 . . . . 0.0 111.466 171.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -69.35 -42.12 75.71 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.427 -0.795 . . . . 0.0 112.264 -171.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 ptpt -70.44 -25.58 63.26 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.2 -0.938 . . . . 0.0 113.068 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -71.89 2.48 5.46 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 166.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.9 mt -110.78 -43.22 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.572 1.549 . . . . 0.0 110.895 168.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.8 t -79.8 -63.89 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 119.176 0.898 . . . . 0.0 112.447 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.06 -28.44 68.2 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.329 -0.857 . . . . 0.0 112.456 -175.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.71 -17.39 64.07 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 168.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -34.21 17.67 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.636 1.174 . . . . 0.0 111.093 170.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.5 mm -61.69 -21.76 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 120.537 -1.352 . . . . 0.0 112.451 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.4 p -90.3 -4.83 56.88 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 171.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -93.54 -56.81 2.79 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.993 1.269 . . . . 0.0 112.517 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.0 m -117.61 -37.85 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -166.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.45 -90.77 0.13 Allowed Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.08 1.324 . . . . 0.0 112.057 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.4 tp -167.35 -47.75 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.566 1.547 . . . . 0.0 111.52 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -96.03 19.36 11.74 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.626 1.57 . . . . 0.0 113.163 -168.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -149.54 -5.02 0.38 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.808 2.043 . . . . 0.0 113.268 -159.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.91 161.66 24.26 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.086 1.354 . . . . 0.0 112.396 172.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -98.62 113.99 26.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.376 0.608 . . . . 0.0 111.327 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.64 -23.23 65.92 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.379 1.472 . . . . 0.0 113.737 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.7 m -65.74 -38.23 88.55 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.132 0.973 . . . . 0.0 112.104 174.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -69.48 -35.18 75.33 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 120.599 -1.313 . . . . 0.0 112.146 177.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.57 -54.62 43.23 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.404 0.682 . . . . 0.0 110.82 167.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.7 p -66.58 -28.43 68.51 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -61.2 -52.31 65.35 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.93 1.692 . . . . 0.0 112.473 170.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.4 mtp-105 -87.1 -35.82 18.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -172.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.72 -18.85 46.5 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.464 1.506 . . . . 0.0 111.402 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.75 65.21 0.84 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.303 1.841 . . . . 0.0 112.008 177.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.1 pt -131.24 174.01 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 127.175 2.19 . . . . 0.0 110.566 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.0 m -69.38 139.11 54.13 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.083 1.353 . . . . 0.0 109.247 165.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.2 t -57.36 -39.14 66.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.301 0.64 . . . . 0.0 111.575 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -68.53 -27.94 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.442 0.905 . . . . 0.0 113.442 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.03 -35.14 76.28 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 111.286 173.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.07 64.07 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.854 0.752 . . . . 0.0 110.469 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.23 -37.32 69.55 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.528 1.131 . . . . 0.0 112.934 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.9 t -86.87 -35.96 18.72 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -63.35 -35.42 80.33 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.041 -1.037 . . . . 0.0 112.916 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mt -48.02 -44.37 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.99 1.316 . . . . 0.0 111.442 173.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -86.42 -34.86 20.02 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -67.1 -30.4 70.41 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 118.299 0.5 . . . . 0.0 112.082 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -81.27 -50.62 9.31 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.962 1.305 . . . . 0.0 113.712 176.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -95.35 -31.7 13.3 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -169.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.2 tpp85 44.2 36.11 1.43 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 128.846 2.858 . . . . 0.0 115.261 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.6 mtp 57.08 22.51 7.48 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.58 1.552 . . . . 0.0 114.422 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.15 40.26 2.54 Favored Glycine 0 N--CA 1.472 1.05 0 C-N-CA 125.249 1.404 . . . . 0.0 111.33 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? 53.48 -73.08 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.85 2.46 . . . . 0.0 111.215 -148.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.0 p -145.85 19.81 1.46 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.034 2.134 . . . . 0.0 114.084 -173.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 62.24 38.54 13.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 125.488 1.515 . . . . 0.0 113.18 -171.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -93.08 -2.78 55.19 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 175.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -72.46 16.25 0.15 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.407 1.883 . . . . 0.0 115.291 -175.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.0 pttp -83.84 -6.08 59.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.004 2.122 . . . . 0.0 113.655 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 61.9 m -138.24 -47.79 0.53 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.949 2.099 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.0 mt -76.83 156.0 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.776 1.23 . . . . 0.0 109.684 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 67.82 -4.43 0.98 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 127.415 2.286 . . . . 0.0 116.698 178.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 34.5 mtm -85.99 -49.08 8.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.704 1.138 . . . . 0.0 112.359 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -88.05 -19.29 27.31 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.574 1.15 . . . . 0.0 113.287 -174.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -97.64 13.1 31.37 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.18 1.792 . . . . 0.0 113.321 -172.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.87 112.57 12.42 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.597 1.159 . . . . 0.0 112.696 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -143.01 141.62 31.39 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.492 1.917 . . . . 0.0 110.475 173.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.7 t -134.7 -49.76 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.571 1.148 . . . . 0.0 111.695 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 71.6 p -116.62 17.33 15.32 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.745 1.618 . . . . 0.0 113.667 -176.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 74.8 m 50.18 33.76 7.65 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 126.522 1.929 . . . . 0.0 114.194 -174.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -141.65 165.12 28.35 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.956 2.102 . . . . 0.0 110.971 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.5 m -142.96 158.73 43.32 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.04 1.336 . . . . 0.0 111.627 -168.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.52 28.61 9.97 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.226 1.411 . . . . 0.0 114.699 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -69.82 149.3 96.61 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 125.307 1.443 . . . . 0.0 111.806 -176.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -69.79 104.92 1.4 Allowed 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.137 2.558 . . . . 0.0 110.818 175.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -142.51 89.69 2.17 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.228 1.411 . . . . 0.0 109.808 -174.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 97.8 mt -125.88 78.28 69.81 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.498 1.519 . . . . 0.0 110.735 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.254 1.282 0 C-N-CA 124.027 3.151 . . . . 0.0 113.315 -179.875 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 51.8 m -127.82 155.01 44.77 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.498 1.519 . . . . 0.0 111.973 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -115.51 121.81 43.82 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.85 1.26 . . . . 0.0 111.5 -177.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 92.6 mtp -139.12 109.58 6.56 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.389 1.476 . . . . 0.0 109.563 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -145.44 39.45 1.17 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.296 1.439 . . . . 0.0 112.381 -172.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 15.0 m -118.12 18.25 13.87 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.222 1.409 . . . . 0.0 114.212 -159.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -150.89 -10.72 0.23 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -173.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -124.5 7.22 8.29 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 126.127 1.771 . . . . 0.0 112.798 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.56 26.19 3.73 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.904 1.682 . . . . 0.0 111.864 -167.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.0 mp -118.68 60.47 0.8 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.728 1.611 . . . . 0.0 110.602 -177.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -139.32 -38.34 0.49 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.466 1.106 . . . . 0.0 113.485 -178.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -79.32 24.79 0.33 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.68 1.592 . . . . 0.0 114.221 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.7 mt -76.76 139.68 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 126.225 1.81 . . . . 0.0 111.142 -172.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 75.7 mt -109.26 133.54 54.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 125.523 1.529 . . . . 0.0 109.359 175.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -133.91 127.15 31.89 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.131 1.372 . . . . 0.0 110.245 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -154.4 -57.98 0.11 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.807 0.843 . . . . 0.0 112.447 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.7 pt -139.36 99.12 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.574 1.55 . . . . 0.0 110.671 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -132.02 -84.88 0.49 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.679 1.192 . . . . 0.0 110.584 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -147.76 25.99 1.03 Allowed 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.757 2.023 . . . . 0.0 111.861 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -76.78 122.53 24.9 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.678 1.191 . . . . 0.0 110.624 -174.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.61 -69.11 0.52 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.488 1.515 . . . . 0.0 112.856 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.6 mt -111.14 -1.64 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.063 1.745 . . . . 0.0 112.563 -171.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -72.67 -18.98 61.51 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.413 1.485 . . . . 0.0 112.261 -171.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.2 t -80.98 -44.71 17.73 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.388 1.075 . . . . 0.0 112.371 178.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -83.68 -18.08 39.24 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 -176.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.2 p -86.4 -13.88 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.452 1.101 . . . . 0.0 113.208 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.9 t -122.56 74.28 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.678 1.591 . . . . 0.0 109.86 177.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.4 tp -140.93 142.6 34.38 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.119 1.368 . . . . 0.0 111.669 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -134.32 35.73 3.22 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 125.959 1.704 . . . . 0.0 113.66 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -132.91 66.28 75.91 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 123.959 0.904 . . . . 0.0 113.223 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -80.47 61.83 8.34 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.713 2.942 . . . . 0.0 112.354 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -121.02 -40.71 2.59 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.312 1.445 . . . . 0.0 114.195 -172.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.7 t -132.38 71.26 79.47 Favored Pre-proline 0 N--CA 1.482 1.166 0 C-N-CA 124.429 1.092 . . . . 0.0 111.259 -177.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.51 139.46 49.12 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.302 2.668 . . . . 0.0 112.676 175.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.2 t -100.62 73.69 1.63 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.934 1.694 . . . . 0.0 111.815 -166.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -103.11 13.52 33.92 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 -172.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt -89.03 59.9 5.2 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.402 1.481 . . . . 0.0 112.917 -164.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.6 t -133.17 6.21 3.87 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -171.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 167.81 38.9 0.02 OUTLIER Glycine 0 CA--C 1.533 1.215 0 O-C-N 121.002 -1.062 . . . . 0.0 114.706 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -76.1 -53.86 7.69 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 118.539 1.169 . . . . 0.0 113.112 -172.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 mp -126.03 112.35 15.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.507 2.323 . . . . 0.0 109.996 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -92.3 -81.94 0.33 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.998 1.319 . . . . 0.0 111.552 173.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -159.07 -29.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.66 -170.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -82.4 -31.63 29.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.204 0.602 . . . . 0.0 111.5 170.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.86 -41.66 82.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.232 -0.918 . . . . 0.0 112.288 -175.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -69.46 -26.4 64.56 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.882 -1.136 . . . . 0.0 113.116 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -69.03 -3.6 13.71 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 166.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.1 mt -100.88 -54.56 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.788 1.235 . . . . 0.0 109.82 164.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.71 -56.7 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 119.398 0.999 . . . . 0.0 112.797 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.08 -30.45 70.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.577 -0.702 . . . . 0.0 111.338 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.55 -46.1 91.45 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 167.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -36.49 82.74 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.519 1.054 . . . . 0.0 111.826 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -24.81 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 O-C-N 120.7 -1.25 . . . . 0.0 112.009 172.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -79.9 -16.2 55.82 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 171.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.96 -50.89 5.11 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.695 -1.253 . . . . 0.0 112.002 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.7 m -124.49 -12.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -167.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 122.62 -74.82 0.37 Allowed Glycine 0 N--CA 1.468 0.831 0 C-N-CA 125.546 1.546 . . . . 0.0 112.602 164.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.5 tp -166.84 -41.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.332 1.453 . . . . 0.0 112.244 175.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.0 m-80 -108.81 -6.25 15.91 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -166.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -93.74 -19.45 21.06 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.156 0.982 . . . . 0.0 113.09 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -65.93 162.48 19.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.861 1.264 . . . . 0.0 112.21 166.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -112.23 167.1 10.69 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.541 1.162 . . . . 0.0 111.876 172.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.54 -21.55 35.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.656 1.182 . . . . 0.0 112.81 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.4 m -63.88 -48.68 75.71 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.489 1.516 . . . . 0.0 111.394 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -65.12 -43.04 93.27 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.088 -1.007 . . . . 0.0 111.956 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -56.96 -54.53 45.65 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.784 0.834 . . . . 0.0 112.067 171.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -63.61 -21.83 66.57 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt -79.21 -44.8 21.12 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.837 1.255 . . . . 0.0 112.094 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -80.34 -36.55 34.02 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.65 1.18 . . . . 0.0 113.401 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 mt -87.64 -20.83 25.79 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.385 1.474 . . . . 0.0 113.167 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.85 61.25 1.96 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.27 1.428 . . . . 0.0 111.94 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -123.56 169.31 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 127.052 2.141 . . . . 0.0 110.557 174.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -65.57 138.53 58.1 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.832 1.253 . . . . 0.0 109.605 164.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 13.3 t -57.54 -38.06 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 123.407 0.683 . . . . 0.0 111.496 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -72.05 -25.93 61.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.82 -36.53 75.68 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.568 -0.729 . . . . 0.0 110.676 169.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.13 71.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.852 0.751 . . . . 0.0 110.904 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -53.59 -41.01 66.14 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.292 1.437 . . . . 0.0 112.705 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -87.63 -33.34 18.86 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -63.29 -36.16 82.74 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.809 -1.182 . . . . 0.0 112.68 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.85 -45.38 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.847 1.259 . . . . 0.0 111.448 174.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -90.74 -27.7 18.76 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -71.93 -28.2 63.32 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 120.158 1.345 . . . . 0.0 112.805 176.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.8 t -85.04 -45.46 12.1 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.011 0.924 . . . . 0.0 113.308 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -96.7 -38.58 9.86 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -173.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 45.09 46.07 9.33 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 127.846 2.458 . . . . 0.0 113.844 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.3 mmt 60.67 -27.17 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 129.076 2.951 . . . . 0.0 116.768 -173.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.03 32.98 0.08 OUTLIER Glycine 0 CA--C 1.534 1.228 0 C-N-CA 125.839 1.685 . . . . 0.0 113.477 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 52.11 77.85 0.14 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.825 2.45 . . . . 0.0 113.94 -169.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.8 p 55.48 31.76 17.63 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.493 1.917 . . . . 0.0 114.349 168.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.45 -13.82 61.95 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.756 2.022 . . . . 0.0 112.496 -173.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -60.35 -19.9 57.37 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.764 2.826 . . . . 0.0 112.874 174.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.79 18.93 0.15 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.294 1.837 . . . . 0.0 115.443 -176.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -81.78 -4.35 56.15 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -142.87 -49.09 0.34 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.108 1.763 . . . . 0.0 110.256 -167.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.9 pt -70.89 161.15 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.694 1.198 . . . . 0.0 112.22 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.29 -9.02 0.13 Allowed 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 127.202 2.201 . . . . 0.0 116.389 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 39.6 mtm -89.04 -36.44 15.79 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.871 1.214 . . . . 0.0 113.462 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -86.83 -19.11 29.44 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -76.75 146.38 37.99 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.581 1.153 . . . . 0.0 111.512 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -145.0 133.85 22.38 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.488 1.115 . . . . 0.0 111.672 -176.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -92.22 137.54 32.28 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.383 1.073 . . . . 0.0 111.7 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.2 t -121.03 -48.89 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.469 1.108 . . . . 0.0 111.039 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 60.0 p -112.79 1.26 15.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.61 1.564 . . . . 0.0 113.963 176.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.9 m -119.21 5.38 11.24 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.868 1.667 . . . . 0.0 114.619 -171.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.57 130.62 39.11 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.33 -0.856 . . . . 0.0 112.014 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.7 m -141.18 129.55 22.42 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.48 1.512 . . . . 0.0 110.278 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 57.32 14.92 2.35 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -86.13 148.26 47.19 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.779 1.231 . . . . 0.0 111.826 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -79.15 52.01 4.1 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.455 3.436 . . . . 0.0 111.722 173.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -128.45 71.15 1.38 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.015 1.726 . . . . 0.0 110.839 -170.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 8.1 mp -114.47 88.87 16.58 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.348 1.459 . . . . 0.0 109.515 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo . . . . . 0 C--O 1.253 1.272 0 C-N-CA 123.862 3.041 . . . . 0.0 113.218 -179.779 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.709 0 N-CA-C 111.999 -0.441 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 4.5 t 57.74 -171.07 0.1 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.567 1.547 . . . . 0.0 113.771 -172.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -134.57 127.33 31.07 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.724 1.609 . . . . 0.0 110.172 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 66.0 mtt -133.63 92.27 2.96 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.845 1.258 . . . . 0.0 110.3 -175.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.58 97.85 2.3 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.538 1.135 . . . . 0.0 110.854 178.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 22.7 m -124.04 -2.15 8.21 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -175.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -146.91 1.96 0.78 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 115.03 1.492 . . . . 0.0 115.03 -176.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -121.52 8.7 10.15 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.203 1.801 . . . . 0.0 111.869 171.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.47 49.05 1.1 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.065 1.746 . . . . 0.0 110.79 -165.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -140.9 149.86 42.46 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.09 1.756 . . . . 0.0 111.523 171.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -153.05 -52.33 0.1 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.428 1.091 . . . . 0.0 112.267 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -135.8 72.37 1.44 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.685 1.594 . . . . 0.0 109.447 -177.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.7 mm -115.76 119.17 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.568 1.547 . . . . 0.0 109.626 -173.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 41.8 mt -139.81 103.13 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.943 1.297 . . . . 0.0 109.803 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -131.3 106.47 8.31 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.679 1.592 . . . . 0.0 109.495 174.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -156.12 148.98 24.08 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.296 1.438 . . . . 0.0 110.759 -176.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.274 39.1 pt 43.91 60.67 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 126.988 2.115 . . . . 0.0 114.634 176.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -92.76 -88.18 0.22 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.167 1.387 . . . . 0.0 111.191 -172.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -150.96 28.36 0.68 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 126.728 2.011 . . . . 0.0 111.726 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -86.37 122.09 29.86 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.536 1.134 . . . . 0.0 110.812 -177.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.14 -71.75 0.4 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.655 1.582 . . . . 0.0 112.079 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.0 mt -124.35 -1.1 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.966 1.307 . . . . 0.0 113.375 -168.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -67.22 -21.82 65.74 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.032 -1.042 . . . . 0.0 113.035 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.0 p -80.82 -32.65 35.13 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -173.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -101.44 -13.35 17.99 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.0 t -85.19 -36.81 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.956 0.903 . . . . 0.0 111.36 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.4 t -106.7 80.56 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 124.946 1.298 . . . . 0.0 109.768 -177.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.4 tp -120.84 152.42 38.41 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.699 1.6 . . . . 0.0 111.65 -178.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -129.93 25.48 5.28 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.541 1.536 . . . . 0.0 114.24 -174.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -131.79 61.29 57.42 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.61 1.164 . . . . 0.0 113.332 173.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -80.52 67.61 8.58 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.519 2.813 . . . . 0.0 112.014 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 94.4 mtt-85 -122.25 -64.59 1.19 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.004 1.321 . . . . 0.0 113.325 -173.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -158.02 126.75 2.99 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 125.324 1.45 . . . . 0.0 111.059 -178.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -83.17 140.68 9.98 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.8 3.0 . . . . 0.0 111.332 168.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.1 t -130.29 72.0 1.48 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 122.848 1.309 . . . . 0.0 111.754 -176.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -122.31 17.5 10.64 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.391 1.477 . . . . 0.0 114.045 -174.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.53 41.85 1.06 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.433 1.893 . . . . 0.0 111.822 -174.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.2 t -138.1 7.81 2.69 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.883 1.273 . . . . 0.0 114.184 -169.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.16 -56.78 7.5 Favored Glycine 0 CA--C 1.536 1.4 0 O-C-N 120.805 -1.185 . . . . 0.0 114.467 -170.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -92.68 -33.94 14.16 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -177.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.95 142.29 30.66 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.202 2.201 . . . . 0.0 108.997 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -116.37 -72.54 0.69 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.439 1.896 . . . . 0.0 111.84 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.84 -45.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.975 0.51 . . . . 0.0 111.158 -172.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -63.48 -30.65 71.74 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.467 0.707 . . . . 0.0 110.941 174.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -69.14 -35.4 76.32 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 111.842 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -70.54 -35.66 73.26 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.394 -0.816 . . . . 0.0 112.167 170.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -62.61 -7.43 4.74 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 170.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.3 mt -102.98 -55.43 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 125.581 1.552 . . . . 0.0 110.609 170.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 39.3 t -83.9 -55.2 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -172.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.02 -30.04 70.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.874 0.761 . . . . 0.0 112.189 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.17 -38.36 79.59 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.216 0.606 . . . . 0.0 112.431 167.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.82 -36.82 78.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.263 1.025 . . . . 0.0 111.694 173.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.79 -26.66 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 120.851 -1.156 . . . . 0.0 111.555 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -81.0 -8.73 59.84 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 171.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -98.78 -57.84 2.09 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.477 1.489 . . . . 0.0 112.33 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.6 m -118.0 -18.32 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 -164.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.98 -92.27 0.27 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.73 1.634 . . . . 0.0 110.468 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -166.82 -29.41 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.197 1.799 . . . . 0.0 112.976 173.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -99.36 -14.58 19.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.399 1.48 . . . . 0.0 114.133 -176.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -93.87 -14.99 25.47 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.216 1.006 . . . . 0.0 113.413 -175.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.85 166.29 21.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.639 1.576 . . . . 0.0 114.0 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -108.88 115.63 30.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.621 1.169 . . . . 0.0 111.189 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.36 63.27 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.002 1.321 . . . . 0.0 113.775 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.9 m -65.89 -40.01 91.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.102 0.961 . . . . 0.0 111.939 175.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -66.33 -37.41 85.31 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.437 -1.414 . . . . 0.0 112.244 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.68 -50.12 73.78 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.169 0.587 . . . . 0.0 110.817 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.6 p -69.9 -29.66 66.9 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -66.19 -36.59 83.49 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.321 1.449 . . . . 0.0 112.974 173.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.4 mmt-85 -92.83 -39.29 11.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.672 1.189 . . . . 0.0 113.535 -176.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 tt -80.82 -20.2 42.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.628 1.171 . . . . 0.0 111.976 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.24 65.79 0.49 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.67 1.988 . . . . 0.0 112.403 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.6 pt -132.65 -178.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 128.118 2.567 . . . . 0.0 109.295 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -81.53 156.13 25.41 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.361 -0.837 . . . . 0.0 111.052 165.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -58.51 -39.37 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.163 0.985 . . . . 0.0 111.241 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -69.76 -26.47 64.32 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.83 -40.42 87.98 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.701 0.682 . . . . 0.0 111.186 168.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.82 -48.68 65.56 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.349 0.522 . . . . 0.0 109.903 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -53.57 -39.06 64.48 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.433 1.493 . . . . 0.0 112.707 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -84.65 -41.77 16.0 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.851 0.75 . . . . 0.0 112.509 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.59 -35.98 77.44 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.14 -0.975 . . . . 0.0 113.129 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.2 mt -47.62 -51.65 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.297 1.439 . . . . 0.0 111.342 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -85.35 -33.46 22.04 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.73 -29.48 68.72 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -176.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.9 t -85.06 -41.64 15.57 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.672 1.189 . . . . 0.0 113.532 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -142.46 48.19 1.56 Allowed 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -167.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -54.98 -40.25 69.87 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.767 1.227 . . . . 0.0 113.709 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 64.1 mtt -86.53 -25.24 25.16 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.714 1.206 . . . . 0.0 113.107 -177.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.4 -14.34 64.07 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 125.413 1.483 . . . . 0.0 114.878 175.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -118.52 23.21 11.65 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.341 1.857 . . . . 0.0 112.866 170.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m 48.65 38.58 11.69 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 127.237 2.215 . . . . 0.0 113.109 177.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 57.11 5.61 0.27 Allowed 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 -174.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -3.06 50.75 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 119.749 -1.844 . . . . 0.0 114.186 -170.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -70.06 12.76 0.19 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.934 2.094 . . . . 0.0 115.077 -176.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -86.04 -15.42 41.38 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.873 1.669 . . . . 0.0 113.883 -173.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.5 m -123.37 -42.88 2.21 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.167 1.787 . . . . 0.0 110.857 -171.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -72.33 166.61 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 124.612 1.165 . . . . 0.0 108.783 167.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? 67.58 -8.31 0.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.996 2.119 . . . . 0.0 116.138 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.26 -10.4 8.96 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -114.9 -14.91 11.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -161.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -89.81 7.46 36.91 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.963 1.305 . . . . 0.0 114.116 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -95.51 154.97 16.94 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.871 1.668 . . . . 0.0 113.369 -172.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -76.16 145.86 39.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.113 0.965 . . . . 0.0 111.8 171.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.4 t -131.75 -47.51 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 124.269 1.028 . . . . 0.0 112.218 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.4 m -116.07 3.27 13.55 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.794 1.238 . . . . 0.0 113.315 -177.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.2 m -94.32 -5.27 47.0 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.246 1.418 . . . . 0.0 114.465 -169.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -83.62 139.86 32.56 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.952 1.301 . . . . 0.0 112.665 -176.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 72.1 m -147.43 146.34 29.53 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.642 1.577 . . . . 0.0 110.968 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 55.04 19.37 2.71 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.071 1.748 . . . . 0.0 115.717 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 51.4 mm-40 -73.84 150.35 88.34 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.529 1.131 . . . . 0.0 111.878 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -79.91 64.14 8.82 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 124.375 3.384 . . . . 0.0 111.669 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 52.67 43.21 31.53 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.865 1.666 . . . . 0.0 112.207 -171.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.2 tp -123.6 89.42 51.29 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.446 1.498 . . . . 0.0 110.639 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 C--O 1.252 1.195 0 C-N-CA 123.732 2.954 . . . . 0.0 113.075 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.511 0 N-CA-C 111.029 -0.829 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.0 m -137.46 132.77 33.83 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.092 1.357 . . . . 0.0 111.424 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -153.91 117.37 4.62 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.659 1.183 . . . . 0.0 110.754 -178.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 1.7 mmt -135.95 67.34 1.47 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.301 1.44 . . . . 0.0 111.765 -175.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -114.68 -12.82 12.14 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 62.9 m -55.97 -29.34 60.08 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.722 2.009 . . . . 0.0 115.033 -173.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.0 mtm -87.17 -12.53 46.66 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.014 1.326 . . . . 0.0 114.002 -172.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -112.66 -26.93 8.38 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.305 1.842 . . . . 0.0 111.952 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -70.5 -31.06 68.01 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.007 1.723 . . . . 0.0 113.06 175.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.7 mt -103.57 168.83 8.9 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.956 1.302 . . . . 0.0 112.622 -172.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 59.02 19.86 7.66 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 126.567 1.947 . . . . 0.0 115.332 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -92.92 23.42 4.23 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.166 1.787 . . . . 0.0 114.205 -177.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.3 mm -61.91 -32.03 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.721 1.208 . . . . 0.0 113.25 -165.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.2 mt -125.98 65.79 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 125.163 1.385 . . . . 0.0 109.549 -178.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -126.95 -26.57 3.14 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -152.6 -60.14 0.15 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.266 0.939 . . . . 0.0 113.529 -175.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.282 0.5 OUTLIER 62.43 124.33 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 130.243 3.417 . . . . 0.0 114.072 -176.324 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -131.92 35.89 3.72 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.19 1.396 . . . . 0.0 112.256 -177.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -63.08 -21.39 66.14 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.607 0.763 . . . . 0.0 111.49 160.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -148.04 141.18 25.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.906 1.682 . . . . 0.0 112.344 174.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.6 -88.06 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.92 1.688 . . . . 0.0 111.442 176.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 88.0 mt -131.4 10.81 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 126.857 2.063 . . . . 0.0 111.229 -168.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -91.26 -1.11 57.75 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.194 -1.566 . . . . 0.0 114.028 -172.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.3 t -118.23 -50.02 2.47 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.648 1.179 . . . . 0.0 112.717 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -61.42 -28.45 69.27 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.5 t -85.38 -27.16 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.455 1.502 . . . . 0.0 112.035 175.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.0 t -110.99 60.57 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.751 1.621 . . . . 0.0 110.194 -174.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.1 mt -135.84 178.3 7.16 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.633 1.973 . . . . 0.0 111.404 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt 59.07 47.04 12.5 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.815 1.646 . . . . 0.0 113.54 -177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 t30 48.93 65.88 6.49 Favored Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 126.568 1.947 . . . . 0.0 113.247 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -78.79 77.41 4.08 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 124.025 3.15 . . . . 0.0 112.066 -169.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -129.42 -52.6 1.18 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.832 1.253 . . . . 0.0 114.089 -176.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.7 t 34.67 76.55 0.42 Allowed Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 127.871 2.469 . . . . 0.0 113.103 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -64.03 162.4 29.51 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.418 2.078 . . . . 0.0 113.462 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.2 p -117.17 55.81 0.83 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.015 1.726 . . . . 0.0 112.943 -161.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.404 ' H ' ' CD ' ' A' ' 30' ' ' GLN . 3.3 pm0 -76.38 27.38 0.12 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.151 1.538 . . . . 0.0 115.151 179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 24.75 1.48 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.808 2.043 . . . . 0.0 113.326 -175.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 62.48 -2.96 0.31 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 129.804 3.242 . . . . 0.0 116.7 174.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.29 -36.47 12.59 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 123.736 0.684 . . . . 0.0 113.756 -165.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -87.56 -45.97 9.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.686 0.794 . . . . 0.0 111.668 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp -121.32 117.63 27.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 128.026 2.53 . . . . 0.0 109.287 173.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -105.21 -70.82 0.76 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 110.995 168.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -163.82 -43.34 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.715 0.806 . . . . 0.0 110.715 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.8 10.82 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.278 1.431 . . . . 0.0 112.799 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -111.89 -46.95 3.18 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.793 1.237 . . . . 0.0 112.482 175.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -67.44 -25.67 66.02 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.746 -1.221 . . . . 0.0 112.641 175.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -65.88 -10.63 40.16 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.491 1.517 . . . . 0.0 113.713 168.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.43 -57.01 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 125.158 1.383 . . . . 0.0 110.226 165.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.2 t -71.27 -49.45 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.064 1.302 . . . . 0.0 112.955 -168.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.1 87.33 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.757 0.708 . . . . 0.0 110.98 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.89 -38.54 82.56 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.21 -34.57 63.76 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.928 0.891 . . . . 0.0 112.346 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.99 -36.04 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.227 -0.921 . . . . 0.0 111.239 170.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.9 m -73.42 -13.41 61.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 172.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -100.8 -40.41 7.33 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.767 1.167 . . . . 0.0 112.323 -172.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.8 m -134.62 -22.47 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -175.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 93.71 135.62 7.66 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 119.619 1.099 . . . . 0.0 111.772 -172.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.15 -25.02 1.3 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 128.167 2.587 . . . . 0.0 114.869 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -89.05 -14.86 35.42 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.158 1.383 . . . . 0.0 113.66 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -114.66 -21.53 10.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.863 1.265 . . . . 0.0 113.47 -172.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.2 169.99 11.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.626 1.171 . . . . 0.0 112.738 171.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p30 -113.25 168.95 9.3 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.036 0.922 . . . . 0.0 111.387 169.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.03 -23.45 35.9 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.217 1.007 . . . . 0.0 112.702 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 m -61.53 -44.62 96.72 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.941 1.696 . . . . 0.0 112.254 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -65.7 -34.04 77.28 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.652 -1.28 . . . . 0.0 112.763 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.54 -51.43 50.89 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.514 0.597 . . . . 0.0 111.483 172.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.4 p -61.98 -18.15 59.44 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -84.19 -32.28 24.66 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.82 1.248 . . . . 0.0 112.826 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -102.69 -36.08 8.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.016 1.326 . . . . 0.0 113.205 -175.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.16 -16.2 41.2 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.679 1.192 . . . . 0.0 113.197 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.25 47.63 13.87 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-O 122.78 1.276 . . . . 0.0 111.628 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.7 pt -110.82 160.0 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 127.969 2.507 . . . . 0.0 109.795 175.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.2 t -68.25 152.04 46.05 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.496 -0.753 . . . . 0.0 110.809 167.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.8 t -58.09 -36.67 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.001 0.92 . . . . 0.0 111.287 -176.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -69.53 -32.25 70.96 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -67.91 -38.87 83.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.787 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.27 -48.79 71.97 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.628 0.649 . . . . 0.0 110.471 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -54.57 -42.34 70.89 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.469 1.507 . . . . 0.0 112.746 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -87.43 -33.37 19.1 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -64.39 -37.33 87.12 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.802 0.841 . . . . 0.0 112.395 177.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.2 mt -48.03 -50.68 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.49 1.116 . . . . 0.0 111.02 174.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -84.64 -30.31 25.0 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -75.85 -24.63 55.77 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.769 1.168 . . . . 0.0 113.391 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.2 t -90.09 -32.84 16.52 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.246 1.018 . . . . 0.0 113.47 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -151.78 62.65 0.86 Allowed 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -176.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 54.3 ttt-85 -56.03 -39.06 71.39 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 64.4 mtt -136.92 -37.15 0.66 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.649 1.58 . . . . 0.0 112.431 175.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.16 95.82 0.1 Allowed Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.317 0.961 . . . . 0.0 112.487 175.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 47.24 33.89 2.8 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 126.505 1.922 . . . . 0.0 113.9 -178.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m 47.33 33.79 2.85 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.935 2.094 . . . . 0.0 112.825 -174.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 54.8 31.19 15.08 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.788 2.035 . . . . 0.0 113.955 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -90.65 -10.82 41.8 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -175.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -76.01 9.83 2.23 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.186 1.794 . . . . 0.0 115.611 -162.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -11.05 58.77 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.421 1.888 . . . . 0.0 114.461 -177.28 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 89.5 m -138.15 -41.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.59 1.556 . . . . 0.0 111.012 -162.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.7 pt -68.03 171.57 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.786 0.834 . . . . 0.0 111.349 171.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? 66.76 -20.18 0.11 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 127.033 2.133 . . . . 0.0 116.054 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 -9.71 11.18 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -111.7 -28.81 7.95 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 -166.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -83.93 154.72 23.22 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.492 1.117 . . . . 0.0 112.315 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -94.49 145.68 24.63 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.844 1.258 . . . . 0.0 112.021 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -118.1 142.54 47.31 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.16 1.384 . . . . 0.0 112.239 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.9 t -122.69 -45.43 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.791 1.236 . . . . 0.0 111.471 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.1 m -121.51 15.2 11.17 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.122 1.369 . . . . 0.0 113.532 -178.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t -141.03 28.34 1.91 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.578 1.551 . . . . 0.0 113.382 -175.44 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -90.86 154.58 19.39 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.751 1.221 . . . . 0.0 112.51 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.7 m -137.76 176.88 8.31 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.96 1.704 . . . . 0.0 110.719 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.71 -15.76 54.29 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -144.05 154.96 58.76 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.985 2.114 . . . . 0.0 111.706 168.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -81.68 56.38 5.9 Favored 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 124.434 3.423 . . . . 0.0 112.258 -177.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -130.94 71.04 1.46 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.395 1.478 . . . . 0.0 110.878 -177.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.3 tp -143.06 135.65 13.53 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.875 1.67 . . . . 0.0 109.754 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 C--O 1.25 1.107 0 C-N-CA 123.32 2.68 . . . . 0.0 112.742 -179.942 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.145 -0.382 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 8.3 t -147.48 157.76 43.71 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.201 1.4 . . . . 0.0 111.604 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -148.1 121.09 8.8 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.912 1.285 . . . . 0.0 111.074 178.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 94.3 mtp -138.02 35.64 2.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.02 1.328 . . . . 0.0 112.789 -177.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -76.77 -61.14 2.07 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.612 0.765 . . . . 0.0 112.392 -177.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 17.8 m 48.64 29.46 2.16 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 127.381 2.272 . . . . 0.0 117.132 171.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.2 mtt -150.33 -40.1 0.13 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.296 1.438 . . . . 0.0 113.355 -177.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -88.32 -4.35 58.7 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.037 1.335 . . . . 0.0 112.919 -174.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.06 20.36 1.6 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.009 1.324 . . . . 0.0 113.021 -162.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mp -138.86 145.25 39.77 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.597 1.159 . . . . 0.0 112.069 174.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -147.01 -20.33 0.4 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.509 1.924 . . . . 0.0 113.016 176.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -81.12 39.61 0.51 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.294 2.238 . . . . 0.0 114.009 -173.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.1 mt -104.1 113.89 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 125.537 1.535 . . . . 0.0 109.452 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.5 mp -130.93 -53.1 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 125.057 1.343 . . . . 0.0 110.388 177.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -127.77 118.6 24.05 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.149 1.38 . . . . 0.0 110.144 174.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -155.59 -171.69 3.87 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.545 1.538 . . . . 0.0 110.47 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.7 tt -124.68 126.3 71.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 127.271 2.228 . . . . 0.0 109.513 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -153.92 178.46 9.9 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.989 2.116 . . . . 0.0 111.883 -173.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -75.1 68.33 1.87 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.494 1.518 . . . . 0.0 112.047 177.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -90.56 24.84 2.49 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.433 1.893 . . . . 0.0 114.791 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.63 -70.16 0.23 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.166 1.786 . . . . 0.0 113.647 -176.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 92.9 mt -131.67 9.72 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.837 1.655 . . . . 0.0 111.229 -171.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -90.51 -5.13 56.38 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.446 -1.409 . . . . 0.0 113.5 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.3 p -113.17 -55.04 2.57 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.466 1.506 . . . . 0.0 112.604 -173.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.1 p-10 -58.87 -24.71 62.53 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.201 1.801 . . . . 0.0 114.965 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t -84.85 -20.27 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 126.04 1.736 . . . . 0.0 112.25 175.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.7 t -128.96 61.84 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 125.636 1.574 . . . . 0.0 110.31 -171.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.2 mt -136.57 163.25 30.98 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.798 1.639 . . . . 0.0 112.682 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -99.11 36.74 1.65 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.843 2.057 . . . . 0.0 112.483 -174.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 t30 50.83 60.93 14.14 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 126.662 1.985 . . . . 0.0 114.172 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -72.25 87.64 0.89 Allowed 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.702 2.935 . . . . 0.0 112.531 -175.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 -132.94 -58.3 0.91 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.379 1.472 . . . . 0.0 113.639 176.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.5 t 40.06 79.81 0.31 Allowed Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 127.679 2.392 . . . . 0.0 113.301 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.64 165.78 28.24 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 122.935 2.424 . . . . 0.0 113.982 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.2 p -117.71 59.15 0.79 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.745 1.618 . . . . 0.0 113.027 -157.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -98.99 18.49 17.13 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -171.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.68 19.55 0.14 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.165 2.186 . . . . 0.0 114.976 -170.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.3 t -147.13 2.17 0.77 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.397 1.879 . . . . 0.0 113.172 -171.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -93.37 -63.71 1.07 Allowed Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.848 1.213 . . . . 0.0 114.043 -174.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -82.94 -26.83 31.04 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -168.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp -139.51 134.75 32.68 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.63 1.572 . . . . 0.0 110.14 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -119.24 -68.12 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.428 1.891 . . . . 0.0 112.415 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -164.56 -39.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -173.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -67.84 -29.94 69.2 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.437 0.695 . . . . 0.0 110.714 171.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -75.2 -35.49 61.5 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.153 0.981 . . . . 0.0 111.909 -173.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -66.58 -36.64 83.11 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.244 -0.91 . . . . 0.0 112.874 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.49 -4.68 2.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 170.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mt -109.78 -52.6 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 125.415 1.486 . . . . 0.0 110.816 168.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.5 t -68.06 -63.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.738 0.815 . . . . 0.0 111.563 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.88 69.39 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.098 0.559 . . . . 0.0 111.583 -175.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -58.03 -37.23 73.95 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.62 -35.52 62.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.884 1.274 . . . . 0.0 111.789 173.228 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.17 -34.54 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.069 -1.644 . . . . 0.0 110.566 173.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -78.7 -1.97 37.04 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 169.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -101.28 -45.5 5.32 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 120.013 1.279 . . . . 0.0 112.55 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.95 -12.37 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.4 -78.51 0.36 Allowed Glycine 0 N--CA 1.469 0.845 0 C-N-CA 125.161 1.363 . . . . 0.0 111.971 166.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.5 tt -161.19 -48.92 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.762 1.225 . . . . 0.0 112.066 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -95.71 -17.93 20.88 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.202 1.801 . . . . 0.0 114.391 -171.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -85.73 -14.29 45.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -167.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 170.77 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.656 1.583 . . . . 0.0 112.761 168.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -124.42 166.22 16.36 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.558 1.17 . . . . 0.0 112.659 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.54 -28.62 56.37 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.134 1.374 . . . . 0.0 112.551 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -64.44 -46.05 84.86 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.388 1.475 . . . . 0.0 112.039 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -61.44 -50.87 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.628 0.771 . . . . 0.0 111.597 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.0 mt -54.51 -42.32 70.68 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.563 -0.711 . . . . 0.0 111.63 176.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 m -60.84 -28.65 68.99 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.209 1.403 . . . . 0.0 113.876 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -85.92 -31.44 22.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.237 1.415 . . . . 0.0 112.588 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -96.68 -33.54 11.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.448 1.099 . . . . 0.0 113.009 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.9 mt -89.8 -17.1 28.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.925 1.29 . . . . 0.0 113.479 175.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.54 54.33 3.08 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 122.843 1.306 . . . . 0.0 112.684 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.2 pt -119.26 164.96 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 126.923 2.089 . . . . 0.0 110.379 175.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.42 HG23 ' H ' ' A' ' 70' ' ' LYS . 8.9 t -74.28 147.99 41.84 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 121.796 -0.565 . . . . 0.0 110.866 166.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.3 t -54.49 -30.66 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.134 1.374 . . . . 0.0 111.08 176.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.55 -27.04 61.13 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.42 ' H ' HG23 ' A' ' 67' ' ' THR . 4.1 mtmp? -81.33 -32.71 32.89 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.361 0.982 . . . . 0.0 111.15 167.147 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.42 74.51 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.969 0.804 . . . . 0.0 111.462 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -68.16 -25.96 65.52 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -94.4 -33.39 13.17 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -57.56 -44.22 85.11 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.214 -0.929 . . . . 0.0 111.852 175.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.8 mt -47.3 -60.72 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.989 1.316 . . . . 0.0 110.631 176.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -77.21 -18.65 57.55 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -175.027 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -82.72 -35.89 26.28 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.583 1.083 . . . . 0.0 112.648 174.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 67.9 m -95.72 -19.22 19.85 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -175.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -145.4 66.24 1.23 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.557 1.143 . . . . 0.0 112.528 173.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -67.71 -47.17 70.12 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 121.198 -0.939 . . . . 0.0 113.399 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 64.6 mtt -116.39 -31.71 5.51 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.014 1.326 . . . . 0.0 112.973 -175.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.37 -66.39 0.04 OUTLIER Glycine 0 N--CA 1.469 0.875 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 173.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -121.2 -97.04 0.46 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.087 1.355 . . . . 0.0 109.102 162.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.7 p -140.33 30.7 1.94 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.053 1.341 . . . . 0.0 113.535 -165.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.9 m120 60.94 16.65 7.13 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -76.76 -8.71 57.81 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.643 -1.286 . . . . 0.0 114.196 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -70.38 13.45 0.17 Allowed 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 125.815 1.646 . . . . 0.0 114.262 176.033 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -85.67 -12.54 51.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.601 2.36 . . . . 0.0 112.878 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 36.3 m -130.42 -42.6 1.18 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.204 1.802 . . . . 0.0 111.269 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.2 mt -71.46 156.45 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.312 1.045 . . . . 0.0 108.34 166.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 65.01 -6.1 0.36 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 117.368 2.358 . . . . 0.0 117.368 171.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -83.6 -28.91 28.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.486 1.039 . . . . 0.0 113.391 175.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -108.62 -14.87 14.54 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.901 1.281 . . . . 0.0 113.43 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -90.6 163.76 14.44 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.239 1.815 . . . . 0.0 112.501 -174.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.9 t70 56.63 -152.04 0.4 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 125.099 1.36 . . . . 0.0 112.73 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -75.54 126.77 31.66 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.367 -1.458 . . . . 0.0 111.412 174.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.2 t -124.9 -41.74 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 124.642 1.177 . . . . 0.0 112.183 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.5 t -130.37 33.42 4.31 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.9 1.28 . . . . 0.0 112.544 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t 54.09 43.9 30.03 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.613 1.565 . . . . 0.0 113.753 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.45 171.58 13.98 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.266 1.427 . . . . 0.0 113.432 -177.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.0 m -146.66 137.07 23.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.788 1.635 . . . . 0.0 109.83 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 51.86 37.22 20.15 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.488 1.115 . . . . 0.0 113.707 -173.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -121.24 82.0 37.78 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 125.814 1.645 . . . . 0.0 111.941 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.0 96.64 0.95 Allowed 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 123.778 2.985 . . . . 0.0 111.464 178.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -103.01 59.91 0.77 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.415 1.486 . . . . 0.0 111.556 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 tt -134.75 72.94 68.19 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.69 1.196 . . . . 0.0 110.91 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo . . . . . 0 C--O 1.253 1.231 0 C-N-CA 124.016 3.144 . . . . 0.0 113.368 176.417 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.546 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 53.0 m -131.5 142.25 49.92 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.303 1.441 . . . . 0.0 111.49 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -147.32 115.33 6.52 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.285 1.034 . . . . 0.0 110.36 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 61.5 mtt -137.17 67.35 1.44 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.313 1.445 . . . . 0.0 110.829 -177.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -135.46 -48.47 0.71 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.53 1.132 . . . . 0.0 113.079 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 13.4 t 63.69 -52.04 0.24 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 128.747 2.819 . . . . 0.0 115.609 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.4 mtt -87.03 -19.32 28.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.72 1.208 . . . . 0.0 114.138 -169.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -93.04 1.12 57.42 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.003 1.721 . . . . 0.0 113.473 -174.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.8 pp0? -127.28 28.22 5.76 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.588 1.555 . . . . 0.0 113.927 -171.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.6 mt -103.52 -63.83 1.15 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.829 1.252 . . . . 0.0 112.89 -174.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -136.48 -1.34 2.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.687 1.195 . . . . 0.0 114.021 -174.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -98.69 78.55 2.36 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.495 1.118 . . . . 0.0 112.318 -176.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 mp -128.19 77.71 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 123.804 0.842 . . . . 0.0 110.199 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.8 mt -135.03 140.32 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 126.465 1.906 . . . . 0.0 109.063 -176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 57.64 -178.0 0.06 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.222 1.809 . . . . 0.0 114.313 -172.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -119.82 145.66 46.43 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.497 1.519 . . . . 0.0 112.091 -174.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.4 pt -115.15 41.26 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.969 1.708 . . . . 0.0 113.359 -164.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.02 170.44 16.59 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.431 1.492 . . . . 0.0 112.48 178.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -73.75 54.7 0.5 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 126.159 1.784 . . . . 0.0 113.148 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -131.15 134.19 46.29 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.578 1.551 . . . . 0.0 111.383 175.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -146.09 -80.11 0.16 Allowed 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.894 1.278 . . . . 0.0 112.125 172.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.1 mt -125.09 7.18 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 125.606 1.563 . . . . 0.0 111.987 -172.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -90.23 -4.23 57.34 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.539 -1.35 . . . . 0.0 113.583 -177.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.3 p -112.61 -59.17 2.05 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.545 1.538 . . . . 0.0 111.826 -174.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -57.75 -25.43 60.43 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.328 1.851 . . . . 0.0 115.313 178.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 85.9 t -87.86 -21.47 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 125.941 1.696 . . . . 0.0 112.001 176.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.7 t -126.76 61.09 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.885 1.674 . . . . 0.0 110.252 -170.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.0 mt -106.57 154.8 20.37 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.835 1.654 . . . . 0.0 112.383 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -119.42 34.93 5.02 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.797 1.639 . . . . 0.0 113.03 -173.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 t30 50.21 68.28 3.58 Favored Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 126.994 2.118 . . . . 0.0 113.566 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.43 83.12 1.94 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.779 2.986 . . . . 0.0 112.417 -174.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? 47.45 53.38 11.09 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 126.143 1.777 . . . . 0.0 112.907 176.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.4 t 52.35 88.99 0.11 Allowed Pre-proline 0 N--CA 1.479 1.011 0 C-N-CA 128.158 2.583 . . . . 0.0 112.617 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.06 163.3 36.43 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.914 2.409 . . . . 0.0 114.32 -177.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.4 p -115.07 64.92 0.68 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.347 1.859 . . . . 0.0 112.876 -161.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -83.82 48.42 1.44 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.566 1.147 . . . . 0.0 113.24 -175.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -75.48 54.48 0.75 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.953 2.101 . . . . 0.0 111.876 174.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.8 t -113.19 3.48 16.05 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.283 1.833 . . . . 0.0 113.898 -171.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.46 -24.73 71.05 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.904 1.24 . . . . 0.0 116.058 -167.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -124.22 5.75 8.48 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.63 1.172 . . . . 0.0 113.487 175.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.39 99.67 4.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.521 1.129 . . . . 0.0 113.218 -172.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.1 m -147.58 90.17 1.83 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.163 2.185 . . . . 0.0 111.322 -171.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.84 5.74 3.59 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 161.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -128.49 -38.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.719 1.207 . . . . 0.0 111.05 172.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -74.74 -32.95 62.26 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.149 1.38 . . . . 0.0 111.942 -173.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -67.9 -36.41 80.16 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.299 -0.875 . . . . 0.0 112.241 171.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -63.29 -4.98 2.92 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 170.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.2 mt -109.54 -15.8 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.052 1.741 . . . . 0.0 112.563 174.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.0 t -128.78 -55.86 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 119.316 0.962 . . . . 0.0 112.904 -172.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.73 -40.67 95.9 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.643 1.11 . . . . 0.0 111.124 173.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -66.49 -27.53 67.86 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 172.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.11 -38.48 56.86 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.303 1.041 . . . . 0.0 111.682 175.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.64 -34.28 54.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.826 -1.171 . . . . 0.0 110.642 169.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -72.44 -10.84 60.29 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -106.78 -42.35 4.97 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.423 1.465 . . . . 0.0 112.894 -173.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -127.18 -14.88 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -173.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.07 -79.67 0.35 Allowed Glycine 0 N--CA 1.468 0.768 0 C-N-CA 125.373 1.463 . . . . 0.0 112.044 165.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tt -164.05 -46.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.945 1.298 . . . . 0.0 112.042 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -98.79 -17.2 18.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.316 1.846 . . . . 0.0 114.531 -172.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -87.15 -14.5 41.07 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -68.78 165.98 18.51 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.342 1.457 . . . . 0.0 112.085 166.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -119.81 169.62 9.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.284 1.04 . . . . 0.0 111.831 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.66 -23.18 42.68 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.388 1.075 . . . . 0.0 112.824 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.3 m -67.41 -46.25 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.827 1.651 . . . . 0.0 112.15 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.16 -29.87 69.68 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 120.453 -1.405 . . . . 0.0 112.829 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.83 -54.56 18.1 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.429 1.091 . . . . 0.0 112.031 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.3 p -60.63 -30.17 69.7 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.732 0.813 . . . . 0.0 112.989 -177.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -69.34 -45.12 70.2 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.374 1.47 . . . . 0.0 113.388 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 75.8 mtt85 -95.6 -36.74 11.14 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.23 -15.65 46.09 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.431 1.493 . . . . 0.0 111.18 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.99 60.2 2.2 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.229 1.812 . . . . 0.0 112.155 175.15 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.0 pt -128.88 162.15 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 128.209 2.603 . . . . 0.0 109.408 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.418 HG23 ' H ' ' A' ' 70' ' ' LYS . 12.8 t -68.29 151.5 46.82 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.499 -0.75 . . . . 0.0 110.666 167.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -58.7 -36.03 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.84 0.856 . . . . 0.0 111.007 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.43 -32.59 73.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 177.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.418 ' H ' HG23 ' A' ' 67' ' ' THR . 58.6 mttt -66.4 -37.52 85.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.6 -0.714 . . . . 0.0 111.064 170.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.83 62.19 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.791 0.723 . . . . 0.0 110.28 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -56.52 -35.28 67.9 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.845 1.658 . . . . 0.0 113.403 178.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -86.95 -43.03 12.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.933 0.788 . . . . 0.0 112.634 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.43 -37.58 78.45 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.735 1.152 . . . . 0.0 113.142 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -47.49 -57.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.544 1.137 . . . . 0.0 110.882 173.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.2 pttm -78.88 -35.13 44.15 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -65.74 -30.02 70.62 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.149 0.886 . . . . 0.0 112.739 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.4 t -78.19 -43.25 29.05 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.448 1.099 . . . . 0.0 112.708 171.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.09 84.15 1.45 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.524 1.13 . . . . 0.0 113.033 -175.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -63.14 -46.75 85.75 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.103 0.961 . . . . 0.0 112.97 175.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 17.0 mmt -116.41 -13.82 10.98 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 126.016 1.726 . . . . 0.0 113.662 -177.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 109.79 -50.77 0.75 Allowed Glycine 0 N--CA 1.473 1.124 0 C-N-CA 125.65 1.595 . . . . 0.0 112.632 176.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.1 mtp85 -111.53 30.92 6.53 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.586 1.554 . . . . 0.0 113.158 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.3 m 50.41 32.85 6.88 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.849 2.059 . . . . 0.0 113.295 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 55.98 9.93 0.52 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.71 2.004 . . . . 0.0 115.728 -172.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.36 10.05 37.68 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.316 1.446 . . . . 0.0 114.246 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.6 p90 -68.75 18.18 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 127.036 2.134 . . . . 0.0 114.717 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -76.97 -25.96 53.39 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.32 2.248 . . . . 0.0 111.474 -177.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 86.1 m -131.11 -42.98 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.892 2.077 . . . . 0.0 111.367 -169.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 mt -76.22 159.21 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.54 1.136 . . . . 0.0 108.859 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 66.93 -22.81 0.11 Allowed 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 127.559 2.344 . . . . 0.0 116.227 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -23.48 26.52 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.798 1.181 . . . . 0.0 114.079 -168.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -107.87 -11.09 15.42 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -92.15 5.78 49.07 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -171.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -84.58 47.34 1.35 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.679 1.592 . . . . 0.0 113.604 -170.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -73.61 139.83 45.77 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.455 1.102 . . . . 0.0 112.376 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 50.3 t -135.05 -51.52 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.723 1.209 . . . . 0.0 111.802 177.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 60.0 p -117.25 19.66 14.03 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.82 1.648 . . . . 0.0 113.634 -173.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.0 t 55.94 43.47 27.32 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.144 1.378 . . . . 0.0 112.754 -171.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -133.49 161.91 33.3 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.374 1.869 . . . . 0.0 111.679 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.1 t -128.94 167.69 17.07 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.274 1.43 . . . . 0.0 112.184 -177.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -78.55 31.09 0.19 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.638 1.975 . . . . 0.0 114.002 -175.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 49.57 66.57 5.46 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.072 2.149 . . . . 0.0 113.036 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -65.05 101.2 0.39 Allowed 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 124.108 3.205 . . . . 0.0 111.742 -177.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -145.77 47.22 1.26 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.78 1.632 . . . . 0.0 110.896 -175.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.5 tt -127.73 71.27 77.86 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 125.344 1.458 . . . . 0.0 110.312 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.258 0 C-N-CA 124.044 3.163 . . . . 0.0 113.141 179.589 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.551 0 N-CA-C 111.631 -0.587 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 79.0 p -145.83 160.71 41.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.463 1.505 . . . . 0.0 112.196 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -142.79 110.3 5.77 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.615 1.166 . . . . 0.0 110.876 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.5 mtt -142.79 59.06 1.43 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.49 1.516 . . . . 0.0 110.621 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -129.25 26.31 5.44 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.204 1.401 . . . . 0.0 113.79 -173.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 35.9 m -112.52 16.98 19.62 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -158.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ptm -150.77 -13.07 0.23 Allowed 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 -176.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -132.17 7.1 4.25 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.221 1.408 . . . . 0.0 112.851 -174.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.67 29.06 1.75 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.554 1.942 . . . . 0.0 110.781 -172.158 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -101.32 93.27 5.34 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.47 1.508 . . . . 0.0 110.052 -179.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -144.48 102.14 3.78 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.595 1.958 . . . . 0.0 107.176 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -74.75 145.62 42.86 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.268 0.627 . . . . 0.0 111.427 170.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -134.89 43.83 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.446 1.099 . . . . 0.0 110.914 -168.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.8 mt -111.18 95.43 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.529 1.532 . . . . 0.0 109.63 -173.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.6 mp0 -123.27 78.31 1.56 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.339 1.456 . . . . 0.0 110.454 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -134.23 9.45 3.77 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 20.7 pt -117.01 78.65 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.71 1.604 . . . . 0.0 111.981 -171.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -134.21 34.19 3.31 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.539 1.535 . . . . 0.0 113.946 -173.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt 53.35 41.89 32.08 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.771 1.629 . . . . 0.0 113.738 174.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.253 2.5 mt-10 58.41 26.95 14.77 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 174.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.35 12.61 0.43 Allowed 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -170.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.7 mp -115.15 7.1 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 127.092 2.157 . . . . 0.0 112.225 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -86.07 -10.19 55.38 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.386 -1.446 . . . . 0.0 114.184 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.8 t -114.42 -48.82 2.86 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.749 1.22 . . . . 0.0 112.449 -170.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -59.47 -22.3 61.33 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.7 p -107.52 -6.09 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.972 1.709 . . . . 0.0 113.344 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.0 t -133.5 57.4 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.828 1.651 . . . . 0.0 110.332 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.9 tp -115.51 140.55 49.05 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.966 1.306 . . . . 0.0 111.584 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -128.21 37.25 4.18 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.782 1.633 . . . . 0.0 113.02 -176.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.5 t30 49.02 65.84 6.55 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 126.37 1.868 . . . . 0.0 113.225 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -71.19 86.46 0.78 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 124.007 3.138 . . . . 0.0 112.566 -171.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -130.56 -42.23 1.17 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.021 1.728 . . . . 0.0 113.428 179.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 t -132.72 86.26 44.7 Favored Pre-proline 0 N--CA 1.48 1.035 0 C-N-CA 124.459 1.104 . . . . 0.0 110.859 -174.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.82 160.57 37.34 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.067 2.511 . . . . 0.0 112.718 173.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.8 p -77.29 60.26 1.94 Allowed 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.953 2.501 . . . . 0.0 113.558 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -84.92 18.7 2.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.366 1.867 . . . . 0.0 115.459 -172.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.29 51.96 2.14 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.944 1.698 . . . . 0.0 113.553 -159.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t -104.48 -10.78 17.43 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -168.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -90.85 -79.79 1.38 Allowed Glycine 0 CA--C 1.533 1.2 0 C-N-CA 125.514 1.53 . . . . 0.0 112.556 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 63.41 9.11 3.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.155 2.182 . . . . 0.0 116.587 176.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 mp -136.67 122.36 19.8 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.86 1.264 . . . . 0.0 109.782 164.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -129.17 -69.12 0.71 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.934 0.893 . . . . 0.0 112.551 -176.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -156.35 -20.35 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -166.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -93.04 -31.79 14.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.328 0.651 . . . . 0.0 111.465 168.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -79.25 -43.34 23.94 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.804 . . . . 0.0 112.626 -166.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -69.64 -23.47 63.49 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.26 -0.9 . . . . 0.0 112.533 174.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -68.61 -3.7 12.78 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 164.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -106.01 -50.37 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.173 1.389 . . . . 0.0 109.856 165.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 47.5 t -66.69 -62.2 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.417 1.008 . . . . 0.0 111.558 -174.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.75 64.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.907 -0.496 . . . . 0.0 111.944 -175.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -57.15 -39.57 75.49 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 167.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.68 -34.39 64.87 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.221 1.008 . . . . 0.0 112.075 175.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -62.52 -34.26 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 O-C-N 120.656 -1.278 . . . . 0.0 110.081 173.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.4 t -75.32 -10.33 59.37 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 170.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -99.22 -43.9 6.45 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.342 -1.474 . . . . 0.0 112.534 -173.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.4 m -132.51 -11.81 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -171.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.02 -77.73 0.39 Allowed Glycine 0 N--CA 1.471 0.993 0 C-N-CA 125.031 1.3 . . . . 0.0 112.478 165.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 tp -161.88 -44.0 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.763 1.225 . . . . 0.0 112.159 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -109.6 -8.35 14.99 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.299 1.439 . . . . 0.0 114.25 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -89.08 -14.24 36.78 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 112.838 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.36 166.35 18.8 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.065 1.346 . . . . 0.0 112.339 167.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -124.04 165.5 17.37 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.585 1.183 . . . . 0.0 112.33 173.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.55 60.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.592 1.157 . . . . 0.0 112.932 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -65.11 -44.96 87.05 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.454 1.501 . . . . 0.0 111.942 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.27 -32.0 73.42 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.566 -1.334 . . . . 0.0 112.76 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tp -72.51 -47.89 44.88 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.302 0.641 . . . . 0.0 111.555 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.5 p -63.46 -28.68 70.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.443 1.097 . . . . 0.0 113.077 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.71 -37.3 76.5 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.844 1.258 . . . . 0.0 113.34 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -104.4 -33.21 8.69 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -175.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 tt -84.89 -17.69 37.11 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 176.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.89 69.51 0.67 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.43 1.892 . . . . 0.0 112.373 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -134.45 168.9 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.019 2.127 . . . . 0.0 111.254 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.6 m -69.7 136.92 51.6 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.893 1.277 . . . . 0.0 110.042 166.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.2 t -58.09 -35.48 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.169 0.988 . . . . 0.0 111.832 -178.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -69.95 -26.59 64.19 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -78.75 -33.36 46.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.891 169.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -49.47 68.66 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.749 0.704 . . . . 0.0 110.716 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -67.54 -21.04 65.48 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 t -96.33 -35.13 11.32 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.939 0.791 . . . . 0.0 113.047 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -57.72 -43.32 85.2 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.874 0.87 . . . . 0.0 111.935 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.2 mt -46.39 -62.51 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.076 1.35 . . . . 0.0 110.653 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -81.03 5.34 16.76 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -110.05 -31.24 7.44 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.275 1.03 . . . . 0.0 112.766 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.0 t -83.2 -39.26 21.2 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.728 1.211 . . . . 0.0 112.045 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.29 81.98 1.88 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.593 1.557 . . . . 0.0 110.935 175.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -73.52 -31.85 63.91 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.535 1.134 . . . . 0.0 113.589 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 23.1 mmt -133.91 -34.16 1.01 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.871 1.668 . . . . 0.0 112.379 172.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 123.52 -93.85 0.48 Allowed Glycine 0 CA--C 1.527 0.835 0 C-N-CA 125.572 1.558 . . . . 0.0 110.299 -177.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -79.57 39.43 0.41 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.243 1.817 . . . . 0.0 114.106 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m 50.27 29.64 3.88 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 127.965 2.506 . . . . 0.0 114.014 177.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.277 0.7 OUTLIER 47.86 25.05 0.67 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.47 1.908 . . . . 0.0 115.324 -170.665 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.65 -3.56 49.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.615 1.166 . . . . 0.0 113.71 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -75.02 18.77 0.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.839 2.056 . . . . 0.0 114.333 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -68.97 -16.76 63.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.543 2.337 . . . . 0.0 114.003 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 t -144.11 -19.26 0.57 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.582 1.553 . . . . 0.0 113.19 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.98 156.54 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 126.029 1.732 . . . . 0.0 108.896 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.3 -0.38 0.67 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -171.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.5 ptm -125.1 -3.04 7.6 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.298 1.439 . . . . 0.0 114.5 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -129.28 -19.68 3.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -163.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -88.73 153.25 21.24 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.829 1.252 . . . . 0.0 112.371 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -146.35 148.72 32.66 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.505 1.522 . . . . 0.0 110.9 176.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -119.53 143.25 47.69 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.168 1.387 . . . . 0.0 112.208 -176.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.9 t -124.07 -46.51 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 124.629 1.172 . . . . 0.0 111.441 -177.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 57.8 p -113.35 2.22 15.41 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.532 1.533 . . . . 0.0 114.34 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.5 m -132.27 18.87 4.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.666 1.586 . . . . 0.0 114.206 -172.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.35 162.44 27.89 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.465 1.106 . . . . 0.0 113.394 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 69.8 m -131.04 162.23 30.26 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.819 1.648 . . . . 0.0 111.561 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.03 33.53 0.28 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.829 1.652 . . . . 0.0 113.671 -176.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 47.2 58.98 17.03 Favored Pre-proline 0 CA--C 1.553 1.077 0 C-N-CA 127.508 2.323 . . . . 0.0 114.01 -177.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -76.72 63.65 7.43 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 124.938 3.759 . . . . 0.0 112.48 -177.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -121.7 27.83 7.98 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.79 1.636 . . . . 0.0 112.981 -174.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 6.6 mp -118.62 82.22 19.56 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.074 1.75 . . . . 0.0 109.753 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.254 1.293 0 C-N-CA 123.853 3.035 . . . . 0.0 113.321 -179.573 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 52.4 m -134.71 160.77 37.12 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.609 1.563 . . . . 0.0 112.049 -177.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -130.37 138.88 50.61 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.127 1.371 . . . . 0.0 111.359 177.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.2 mmt -129.12 95.31 4.02 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.937 1.295 . . . . 0.0 110.945 -173.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -142.45 19.57 2.05 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.986 1.314 . . . . 0.0 114.044 -176.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.2 t -96.02 2.54 53.45 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.809 1.244 . . . . 0.0 114.339 -173.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -147.86 0.25 0.64 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 -174.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -125.57 3.79 7.58 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.58 1.552 . . . . 0.0 112.854 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.25 34.69 1.2 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.873 1.669 . . . . 0.0 111.247 -165.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -132.05 14.87 4.72 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -169.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -110.66 -56.77 2.31 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.429 1.092 . . . . 0.0 113.604 -176.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -109.66 92.92 4.24 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.716 1.206 . . . . 0.0 110.66 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.5 mm -126.82 121.69 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.784 1.634 . . . . 0.0 108.803 178.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 57.9 mt -137.13 127.73 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.373 1.469 . . . . 0.0 108.845 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -136.31 73.43 1.46 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.969 1.308 . . . . 0.0 110.712 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -152.75 -175.04 5.13 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.234 1.414 . . . . 0.0 110.982 -177.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.323 13.1 tt 50.39 39.57 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 127.534 2.333 . . . . 0.0 114.928 172.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -144.89 -166.24 2.36 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.617 1.167 . . . . 0.0 112.634 -172.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -70.08 88.42 0.59 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.393 1.077 . . . . 0.0 110.463 168.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -133.09 138.77 46.83 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.966 2.106 . . . . 0.0 110.162 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.88 -84.67 0.1 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.858 1.263 . . . . 0.0 111.316 -177.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.7 mp -127.35 -8.28 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 125.305 1.442 . . . . 0.0 113.618 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -73.39 -9.27 58.52 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -169.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.2 t -99.77 -56.33 2.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.825 1.25 . . . . 0.0 112.059 174.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -69.76 -16.43 63.31 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -172.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.6 p -75.35 -15.67 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.045 0.938 . . . . 0.0 112.93 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.5 t -120.47 71.57 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 125.675 1.59 . . . . 0.0 109.786 176.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 tp -140.84 140.68 34.68 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.561 1.144 . . . . 0.0 111.844 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.0 ttmm -121.79 34.14 5.28 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.456 1.902 . . . . 0.0 112.991 -176.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 t30 48.02 64.58 8.35 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 126.346 1.858 . . . . 0.0 113.143 -176.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.76 88.53 0.78 Allowed 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.86 3.04 . . . . 0.0 112.405 -173.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -141.66 -53.75 0.45 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.431 1.492 . . . . 0.0 113.169 176.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.4 t -135.77 77.94 50.0 Favored Pre-proline 0 N--CA 1.482 1.162 0 C-N-CA 124.274 1.03 . . . . 0.0 111.603 -173.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -82.1 96.77 0.89 Allowed 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.22 2.613 . . . . 0.0 111.895 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.1 t -151.3 29.5 0.63 Allowed 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 125.034 1.334 . . . . 0.0 113.757 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -86.06 16.05 4.56 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 -172.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.39 56.78 3.17 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 127.0 2.12 . . . . 0.0 111.776 -170.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.5 t -132.16 5.58 4.15 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 116.058 1.873 . . . . 0.0 116.058 -161.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 164.07 47.97 0.02 OUTLIER Glycine 0 N--CA 1.476 1.316 0 O-C-N 120.697 -1.252 . . . . 0.0 115.765 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -75.06 -48.31 24.57 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.46 1.13 . . . . 0.0 113.671 -171.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp -147.3 145.22 29.3 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.423 2.289 . . . . 0.0 108.983 174.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.1 t -140.6 -62.79 0.49 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.769 1.228 . . . . 0.0 114.084 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -161.11 -26.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -165.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -105.11 12.26 32.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.658 1.583 . . . . 0.0 111.351 176.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -118.7 -48.98 2.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.193 0.997 . . . . 0.0 112.354 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -67.24 -22.71 65.68 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.512 -1.367 . . . . 0.0 112.891 171.381 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -66.47 -11.11 50.59 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 169.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.2 mp -95.01 -60.73 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.54 1.536 . . . . 0.0 108.145 169.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.5 t -77.32 -50.77 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.32 65.09 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.563 -0.711 . . . . 0.0 111.924 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -72.97 -35.29 66.87 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.163 1.385 . . . . 0.0 113.313 168.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.35 -36.98 84.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.822 -1.174 . . . . 0.0 111.58 174.293 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.18 -21.62 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 O-C-N 121.103 -0.998 . . . . 0.0 111.596 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.0 m -89.68 -5.32 57.17 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.746 1.219 . . . . 0.0 114.121 169.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -111.62 -33.21 6.42 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.958 1.254 . . . . 0.0 113.243 -173.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -138.11 -14.16 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 114.911 1.448 . . . . 0.0 114.911 -177.219 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.86 -80.82 0.34 Allowed Glycine 0 N--CA 1.469 0.885 0 C-N-CA 125.135 1.35 . . . . 0.0 112.538 167.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 57.3 tp -168.88 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.153 1.781 . . . . 0.0 111.559 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -116.49 -5.07 11.72 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -165.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.4 m-80 -99.41 -18.74 17.33 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 118.603 0.638 . . . . 0.0 112.671 -178.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pp -65.94 158.01 29.21 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.169 1.388 . . . . 0.0 112.227 170.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -113.02 171.17 7.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.338 1.066 . . . . 0.0 111.661 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.29 -19.88 30.88 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.609 1.164 . . . . 0.0 112.798 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -67.59 -45.92 74.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.031 1.732 . . . . 0.0 112.257 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -65.83 -37.91 87.51 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.698 -1.251 . . . . 0.0 111.983 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.56 -52.93 62.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.69 0.796 . . . . 0.0 111.981 172.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.5 p -62.83 -22.69 66.83 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.044 0.938 . . . . 0.0 113.193 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.8 mttm -77.84 -42.53 33.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.631 1.573 . . . . 0.0 112.598 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -86.55 -38.56 17.06 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.167 0.987 . . . . 0.0 113.231 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 53.1 mt -88.51 -17.6 29.96 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.67 1.188 . . . . 0.0 113.186 -175.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.21 33.3 21.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 125.326 1.45 . . . . 0.0 113.168 -178.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.7 pt -89.86 163.94 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.772 2.029 . . . . 0.0 110.46 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.438 HG23 ' H ' ' A' ' 70' ' ' LYS . 11.0 t -72.39 151.7 42.48 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 121.578 -0.702 . . . . 0.0 110.926 165.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.4 t -57.4 -35.15 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 124.584 1.153 . . . . 0.0 111.372 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -71.73 -32.57 67.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 178.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.438 ' H ' HG23 ' A' ' 67' ' ' THR . 79.8 mttt -69.15 -36.43 77.41 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.789 169.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.6 70.61 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.199 0.909 . . . . 0.0 110.705 176.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -54.19 -42.06 69.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.017 1.727 . . . . 0.0 113.128 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.1 t -85.17 -39.53 17.75 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -59.53 -37.71 79.08 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.804 -1.185 . . . . 0.0 112.893 178.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.0 mt -48.2 -42.07 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.57 1.148 . . . . 0.0 111.914 174.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -95.19 -39.33 10.15 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -71.5 -21.05 61.98 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.221 -0.925 . . . . 0.0 113.42 -175.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.5 t -89.48 -39.44 13.34 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.015 0.926 . . . . 0.0 113.338 173.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -143.97 54.05 1.3 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -169.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 40.4 ttt-85 -55.49 -42.12 73.97 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.005 1.722 . . . . 0.0 113.681 -178.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 76.5 mtm -107.53 -13.23 15.12 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.842 1.257 . . . . 0.0 113.83 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 108.51 122.07 4.63 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 125.508 1.528 . . . . 0.0 111.233 175.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 59.6 mtt-85 45.87 42.83 9.49 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.089 1.756 . . . . 0.0 113.329 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.58 25.57 2.06 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 128.027 2.531 . . . . 0.0 114.692 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.42 27.29 4.79 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.429 1.892 . . . . 0.0 113.757 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.03 -16.41 22.73 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.146 0.978 . . . . 0.0 113.324 -179.295 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -74.38 12.35 0.78 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.655 1.982 . . . . 0.0 115.435 -171.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 6.5 47.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.076 2.151 . . . . 0.0 114.795 -167.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 96.8 m -142.88 -46.59 0.31 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.032 1.733 . . . . 0.0 110.135 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.7 pt -73.87 170.74 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.279 1.432 . . . . 0.0 111.955 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 64.97 -3.79 0.55 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.613 1.965 . . . . 0.0 116.17 176.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 21.6 ptt? -140.23 18.84 2.42 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -144.28 -31.83 0.44 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -68.47 145.87 53.67 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.293 1.437 . . . . 0.0 113.224 175.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -149.44 164.17 35.74 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.357 1.463 . . . . 0.0 113.098 -174.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -134.09 141.33 47.12 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.627 1.571 . . . . 0.0 111.595 177.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.7 t -134.14 -50.72 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.866 1.266 . . . . 0.0 111.546 177.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.0 p -113.71 11.8 18.21 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.805 1.642 . . . . 0.0 114.106 -176.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 t 55.15 50.47 15.15 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.618 1.567 . . . . 0.0 113.356 -176.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -123.31 130.89 53.37 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.397 1.479 . . . . 0.0 111.503 178.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.2 m -142.37 116.51 9.45 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.23 1.412 . . . . 0.0 111.064 -176.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.96 29.22 7.54 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.415 1.486 . . . . 0.0 114.673 -176.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -117.15 153.58 49.79 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 126.895 2.078 . . . . 0.0 112.135 -172.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.09 80.49 2.86 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 124.178 3.252 . . . . 0.0 112.112 -175.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -129.37 83.53 2.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.637 1.575 . . . . 0.0 110.423 -178.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 22.4 tp -138.56 84.07 19.39 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.97 1.308 . . . . 0.0 110.593 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--O 1.253 1.275 0 C-N-CA 123.925 3.083 . . . . 0.0 113.288 -178.672 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 19.8 t -141.56 151.52 43.28 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.348 1.459 . . . . 0.0 111.237 177.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -105.44 99.6 9.21 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.516 1.126 . . . . 0.0 111.088 -174.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 97.4 mmm -124.77 94.58 4.23 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.384 1.474 . . . . 0.0 110.277 -177.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -153.11 -42.3 0.1 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.816 1.247 . . . . 0.0 113.298 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 56.6 p 57.01 -42.32 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 131.098 3.759 . . . . 0.0 117.352 -178.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.4 mtm -93.41 -12.03 30.82 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.316 1.446 . . . . 0.0 114.438 -173.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -97.51 4.7 50.34 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.538 1.535 . . . . 0.0 113.692 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -126.5 16.73 7.61 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.258 1.423 . . . . 0.0 114.791 -171.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.3 mp -77.78 66.65 3.5 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.194 1.398 . . . . 0.0 111.159 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -141.54 -10.67 0.93 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.991 1.317 . . . . 0.0 114.208 -176.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -130.5 124.54 32.18 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.99 1.316 . . . . 0.0 111.342 174.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 22.8 mm -129.34 84.47 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.808 1.643 . . . . 0.0 107.569 179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.3 mt -128.4 116.66 42.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 125.204 1.402 . . . . 0.0 108.556 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -138.4 115.89 11.27 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.943 1.297 . . . . 0.0 110.292 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -154.64 170.96 20.29 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.995 1.718 . . . . 0.0 111.151 178.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.35 11.4 tt 51.31 35.09 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 127.014 2.125 . . . . 0.0 115.547 173.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.71 164.13 20.58 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.035 1.734 . . . . 0.0 112.342 174.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -75.79 42.12 0.23 Allowed 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 126.54 1.936 . . . . 0.0 114.194 -175.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -137.18 130.97 31.85 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.751 1.62 . . . . 0.0 110.969 176.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.31 -75.75 0.11 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.618 1.167 . . . . 0.0 111.685 171.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.2 mt -121.64 -8.76 9.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 125.439 1.496 . . . . 0.0 113.394 -172.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -70.6 -15.84 62.79 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -172.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 28.7 t -80.64 -49.02 11.79 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.935 0.894 . . . . 0.0 112.357 175.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -81.03 -17.68 49.4 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -174.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.5 p -80.86 -18.88 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.165 0.986 . . . . 0.0 112.864 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.5 t -110.19 64.88 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 125.478 1.511 . . . . 0.0 110.146 177.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.5 mt -120.13 110.24 16.4 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.288 1.435 . . . . 0.0 110.317 175.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -134.06 43.72 2.8 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.183 1.793 . . . . 0.0 111.623 -168.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.0 t30 50.58 59.77 15.81 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 126.953 2.101 . . . . 0.0 113.692 -175.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -81.2 58.73 7.09 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 124.329 3.353 . . . . 0.0 113.884 -167.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -138.7 13.59 2.72 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.8 t -119.66 104.1 45.32 Favored Pre-proline 0 N--CA 1.473 0.698 0 C-N-CA 125.653 1.581 . . . . 0.0 110.038 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -77.83 111.46 3.11 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.27 2.647 . . . . 0.0 110.197 168.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 t -140.87 51.28 1.63 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 123.629 1.68 . . . . 0.0 111.932 -175.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -95.44 19.39 10.97 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -170.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.39 34.43 0.81 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 127.008 2.123 . . . . 0.0 112.103 -179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.7 t -151.04 65.38 0.91 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 124.024 1.869 . . . . 0.0 111.171 -173.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.52 -13.71 38.99 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 124.91 1.243 . . . . 0.0 115.223 179.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -79.69 -56.17 4.48 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 118.719 1.259 . . . . 0.0 112.405 174.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.4 109.13 4.38 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.3 1.44 . . . . 0.0 112.07 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.9 t -99.16 -72.0 0.67 Allowed 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 125.587 1.555 . . . . 0.0 111.652 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -161.41 -46.56 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.949 0.499 . . . . 0.0 110.631 -174.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -56.11 -38.47 70.8 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.997 0.919 . . . . 0.0 110.469 172.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -67.37 -36.7 81.89 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.773 1.229 . . . . 0.0 111.8 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mtmt -69.07 -37.5 78.51 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 121.387 -0.821 . . . . 0.0 112.144 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -65.17 -2.44 2.92 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 170.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.7 mt -103.45 -60.98 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.253 1.421 . . . . 0.0 110.411 161.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.0 t -74.52 -53.58 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 CA-C-N 119.776 1.171 . . . . 0.0 113.128 -168.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.98 -34.3 78.11 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.579 -0.7 . . . . 0.0 110.853 177.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.96 -34.04 75.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 170.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.02 75.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.082 -1.011 . . . . 0.0 111.954 174.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.52 -32.17 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.171 -0.956 . . . . 0.0 110.697 172.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.5 m -74.96 -11.64 60.16 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -105.08 -39.45 6.22 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.291 1.405 . . . . 0.0 112.899 -172.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.6 p -129.35 -15.88 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -170.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.81 -85.43 0.23 Allowed Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.726 1.155 . . . . 0.0 111.919 171.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.3 tt -165.88 -41.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.727 1.611 . . . . 0.0 111.142 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -110.32 -6.68 14.94 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.883 1.673 . . . . 0.0 115.305 -169.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -95.89 -14.17 23.36 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 -173.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.88 159.69 24.95 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.349 1.459 . . . . 0.0 114.688 -178.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.7 t-20 -101.0 122.86 44.28 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.961 1.304 . . . . 0.0 111.474 -177.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.98 -21.13 64.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.866 1.266 . . . . 0.0 113.479 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 93.5 m -66.24 -41.33 90.18 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.399 -0.813 . . . . 0.0 111.491 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.91 -43.07 99.61 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.05 -1.031 . . . . 0.0 111.721 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -57.92 -44.56 86.91 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 112.286 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 p -61.86 -27.14 68.57 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.254 -0.904 . . . . 0.0 113.3 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -84.16 -38.5 20.58 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.807 1.643 . . . . 0.0 111.91 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.2 mmt-85 -91.17 -34.67 14.93 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.041 1.336 . . . . 0.0 114.276 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -92.96 -12.69 30.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.364 1.065 . . . . 0.0 112.937 174.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.73 65.33 1.25 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.056 1.343 . . . . 0.0 112.045 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -133.19 163.06 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.601 1.96 . . . . 0.0 111.586 -177.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.5 m -57.43 134.31 55.95 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.912 1.285 . . . . 0.0 109.65 163.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.8 t -59.1 -34.58 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 121.569 -0.707 . . . . 0.0 111.389 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.06 -29.01 64.78 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.249 -0.907 . . . . 0.0 113.363 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.71 -36.36 78.34 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.896 169.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.83 -50.13 65.72 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.08 0.855 . . . . 0.0 110.811 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -54.78 -38.83 67.73 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.195 1.398 . . . . 0.0 112.815 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.4 t -88.15 -34.98 17.67 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 177.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.64 -38.01 83.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.085 -1.009 . . . . 0.0 112.266 177.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.8 mt -48.01 -60.07 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.813 1.245 . . . . 0.0 110.954 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -75.04 -21.9 58.76 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -82.06 -31.68 30.73 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.023 0.829 . . . . 0.0 112.83 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.4 t -85.36 -43.58 13.55 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.765 1.226 . . . . 0.0 112.595 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -133.88 84.24 2.11 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.065 1.346 . . . . 0.0 111.319 178.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -76.89 -41.12 45.0 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.605 0.762 . . . . 0.0 112.936 174.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 66.1 mtt -122.0 -29.59 4.23 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.757 1.623 . . . . 0.0 112.695 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.29 107.63 2.81 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.626 1.584 . . . . 0.0 111.513 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? 44.52 39.2 3.08 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.109 1.764 . . . . 0.0 112.827 -177.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 47.11 30.75 1.42 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.298 2.239 . . . . 0.0 114.021 -178.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 53.91 21.51 2.85 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 125.698 1.599 . . . . 0.0 114.926 -172.052 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . 0.262 0.0 OUTLIER -101.9 27.6 6.39 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 120.042 -1.661 . . . . 0.0 113.07 -172.167 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -114.63 9.95 16.64 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.51 1.524 . . . . 0.0 113.809 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.0 pttt -93.91 -20.85 19.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.399 1.879 . . . . 0.0 115.041 -158.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 m -154.57 -51.48 0.09 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.335 1.854 . . . . 0.0 110.494 -169.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.7 pt -72.02 -174.66 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 111.382 171.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 65.03 -27.2 0.1 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.499 2.32 . . . . 0.0 116.386 -172.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -87.74 -18.57 29.15 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.943 1.247 . . . . 0.0 114.021 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -116.68 3.62 13.06 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.788 1.235 . . . . 0.0 114.135 178.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -100.86 147.07 26.52 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 112.782 -173.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -138.16 42.78 2.22 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.587 1.555 . . . . 0.0 112.079 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -138.54 149.8 45.7 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.004 1.322 . . . . 0.0 112.913 176.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 55.6 t -136.08 -48.1 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 125.408 1.483 . . . . 0.0 111.168 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 63.2 p -118.41 24.39 10.96 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 126.504 1.922 . . . . 0.0 113.229 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . 0.283 86.7 p 52.58 21.84 1.97 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.788 2.435 . . . . 0.0 116.386 -176.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -130.98 111.82 12.39 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.673 1.589 . . . . 0.0 110.782 175.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 66.8 m -146.16 127.04 14.46 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.579 1.552 . . . . 0.0 109.679 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.0 29.99 11.04 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 -175.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -116.91 75.14 7.22 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 126.012 1.725 . . . . 0.0 112.377 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -67.01 114.63 3.25 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.171 2.581 . . . . 0.0 110.379 174.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -137.19 22.24 3.0 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -172.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.4 tp -135.42 84.9 33.48 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.47 1.508 . . . . 0.0 110.923 -174.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 C--O 1.254 1.317 0 C-N-CA 123.926 3.084 . . . . 0.0 113.237 179.685 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 111.219 -0.753 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 31.1 m 58.49 178.56 0.07 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.967 1.707 . . . . 0.0 114.12 -172.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -140.64 133.91 29.67 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.025 0.93 . . . . 0.0 111.829 -178.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 98.3 mmm -133.74 43.65 2.84 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.444 1.497 . . . . 0.0 112.324 -169.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -145.34 95.99 2.76 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.944 1.298 . . . . 0.0 111.276 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.3 m -118.06 7.89 12.33 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.468 1.507 . . . . 0.0 114.493 -175.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -151.69 -9.12 0.21 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -178.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -105.18 2.53 29.29 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.712 1.605 . . . . 0.0 112.369 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.48 15.94 2.01 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.046 1.739 . . . . 0.0 112.217 -166.444 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.9 mp -107.64 132.05 53.73 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.752 1.221 . . . . 0.0 110.361 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -149.22 -35.66 0.18 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.906 1.282 . . . . 0.0 112.645 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -83.39 42.91 0.85 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.819 1.647 . . . . 0.0 113.068 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.5 mm -105.75 134.51 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.589 1.555 . . . . 0.0 110.816 -173.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 73.9 mt -89.65 135.19 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.075 1.35 . . . . 0.0 109.726 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -134.61 164.23 27.96 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.276 1.43 . . . . 0.0 112.499 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -138.68 166.24 24.88 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.789 1.636 . . . . 0.0 111.339 -175.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.328 14.9 tt 47.94 43.23 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 C-N-CA 126.931 2.092 . . . . 0.0 114.042 173.397 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.98 63.19 3.73 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.377 1.471 . . . . 0.0 113.096 -168.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt 52.41 44.86 29.47 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.714 1.606 . . . . 0.0 112.562 -176.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.05 111.39 9.16 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.843 1.257 . . . . 0.0 111.488 -174.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.38 -81.73 0.64 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.651 1.181 . . . . 0.0 112.708 175.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.4 mt -115.15 -11.47 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -167.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -71.63 -18.91 62.18 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -173.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -81.76 -42.77 19.29 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.395 1.078 . . . . 0.0 112.795 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -83.92 -17.91 39.14 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -175.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.3 t -81.2 -32.85 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.521 1.128 . . . . 0.0 111.667 177.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.7 t -113.02 77.41 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.025 1.33 . . . . 0.0 109.851 -176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.6 tt -126.72 131.31 51.38 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.638 1.575 . . . . 0.0 110.399 -177.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -130.09 45.44 2.81 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.406 1.883 . . . . 0.0 112.483 -171.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -126.63 56.04 16.03 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 124.84 1.256 . . . . 0.0 113.604 177.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.2 91.01 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.962 2.441 . . . . 0.0 110.796 175.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.4 mmt-85 -134.29 -69.43 0.53 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.619 1.568 . . . . 0.0 112.412 178.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 93.9 t -149.24 115.53 3.66 Favored Pre-proline 0 N--CA 1.475 0.781 0 C-N-CA 125.094 1.357 . . . . 0.0 109.711 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.35 157.26 25.78 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.976 2.45 . . . . 0.0 112.251 165.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.7 p -85.35 18.38 2.7 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 126.638 1.975 . . . . 0.0 115.462 178.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -113.71 81.82 1.58 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.254 1.022 . . . . 0.0 111.734 -169.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -129.53 35.2 4.24 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.931 1.692 . . . . 0.0 113.134 -178.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.9 t -138.46 10.8 2.74 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.964 1.305 . . . . 0.0 114.194 -166.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.41 -64.58 2.58 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 120.733 -1.23 . . . . 0.0 113.922 -173.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -127.2 1.77 6.43 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.857 1.263 . . . . 0.0 113.866 -171.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp -133.69 134.37 43.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.58 1.552 . . . . 0.0 111.207 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.3 p -106.52 -83.05 0.53 Allowed 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.76 2.424 . . . . 0.0 111.688 -178.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -155.48 -48.97 0.08 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 124.664 1.186 . . . . 0.0 110.774 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.36 -28.55 69.36 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.497 0.719 . . . . 0.0 110.958 172.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -68.69 -37.1 79.3 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.231 1.012 . . . . 0.0 111.775 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -69.24 -34.06 74.24 Favored 'General case' 0 N--CA 1.481 1.112 0 O-C-N 120.788 -1.195 . . . . 0.0 112.971 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -63.56 -3.67 2.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 169.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.6 mt -109.01 -49.67 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.674 1.59 . . . . 0.0 110.687 168.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.96 -65.1 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.71 1.141 . . . . 0.0 112.321 -177.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.28 73.71 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.668 0.787 . . . . 0.0 111.439 -173.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.7 -43.17 94.18 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 170.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -72.0 -35.78 69.56 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.229 -0.92 . . . . 0.0 112.086 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.63 -29.16 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.916 1.286 . . . . 0.0 111.536 170.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.0 t -77.06 -17.46 58.75 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 173.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -95.55 -50.14 5.09 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.704 -1.247 . . . . 0.0 111.996 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.03 -7.1 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -168.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 116.19 -76.08 0.27 Allowed Glycine 0 N--CA 1.467 0.765 0 C-N-CA 125.476 1.512 . . . . 0.0 112.83 163.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -175.05 -33.85 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 127.031 2.133 . . . . 0.0 111.186 179.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -111.72 -6.1 14.37 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.175 1.39 . . . . 0.0 114.536 -165.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -97.32 -21.33 17.29 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.159 0.984 . . . . 0.0 113.236 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.2 pp -68.09 167.05 14.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.53 0.732 . . . . 0.0 112.383 167.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -128.07 170.11 13.3 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.501 1.144 . . . . 0.0 112.28 174.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.94 -32.54 61.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.061 1.344 . . . . 0.0 112.947 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.42 -52.29 64.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.006 1.322 . . . . 0.0 111.149 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.29 -34.28 77.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.066 0.946 . . . . 0.0 112.341 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 tp -66.92 -47.98 70.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.008 0.523 . . . . 0.0 111.361 173.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -60.18 -25.36 65.51 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.853 1.261 . . . . 0.0 113.98 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -82.13 -16.73 48.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.006 1.723 . . . . 0.0 113.434 -177.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -119.85 -42.46 2.61 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.77 1.628 . . . . 0.0 112.137 -175.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tp -76.39 -12.42 60.05 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.371 1.868 . . . . 0.0 112.454 172.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.31 64.56 1.34 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.344 1.858 . . . . 0.0 112.592 170.626 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.8 pt -139.11 174.74 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 127.588 2.355 . . . . 0.0 109.966 -176.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.8 t -75.8 151.59 37.49 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.532 -0.73 . . . . 0.0 110.769 163.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.9 t -60.57 -34.28 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.025 0.93 . . . . 0.0 111.293 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.19 -31.92 72.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -69.23 -35.69 76.42 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.19 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.31 -45.13 73.81 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.02 0.827 . . . . 0.0 110.946 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.78 -39.12 73.5 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.079 1.351 . . . . 0.0 112.813 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -87.3 -40.38 14.54 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.21 -41.65 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.063 -1.023 . . . . 0.0 112.241 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.3 mt -54.68 -36.94 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 124.311 1.044 . . . . 0.0 112.695 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -92.93 -34.6 13.72 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.948 1.249 . . . . 0.0 113.001 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -73.22 -31.94 64.45 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 123.162 0.585 . . . . 0.0 112.536 -170.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 72.6 m -89.2 -33.41 17.03 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.195 1.398 . . . . 0.0 113.701 178.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -152.52 83.48 1.24 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.007 1.323 . . . . 0.0 111.16 -178.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -75.94 -18.66 59.26 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.971 1.308 . . . . 0.0 113.718 176.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 75.5 mtm -82.62 46.93 1.12 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.024 1.73 . . . . 0.0 114.748 -156.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -178.01 17.62 0.03 OUTLIER Glycine 0 CA--C 1.539 1.565 0 C-N-CA 125.544 1.545 . . . . 0.0 114.803 177.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 73.1 mtp85 -87.53 -53.95 4.53 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.033 1.333 . . . . 0.0 113.378 -174.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.8 t -141.8 9.37 1.96 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 126.522 1.929 . . . . 0.0 112.865 -177.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 m120 53.46 20.1 1.91 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.08 2.152 . . . . 0.0 115.894 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -87.72 -4.85 58.89 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.086 1.354 . . . . 0.0 113.85 -175.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -75.93 8.79 2.83 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.484 1.914 . . . . 0.0 115.004 -166.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -85.73 -7.11 58.98 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.918 1.687 . . . . 0.0 114.704 -170.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.5 m -139.39 -43.89 0.45 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.216 1.807 . . . . 0.0 110.315 -165.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 40.1 pt -64.94 172.23 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.832 0.853 . . . . 0.0 111.92 170.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? 66.07 -18.28 0.11 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 127.387 2.275 . . . . 0.0 116.734 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.47 -15.55 8.02 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.402 1.456 . . . . 0.0 114.531 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -104.28 -25.36 12.91 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -165.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -80.41 129.67 34.66 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.7 0.8 . . . . 0.0 112.477 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -159.92 131.57 6.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.158 1.383 . . . . 0.0 111.615 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -148.02 142.08 25.97 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.12 1.768 . . . . 0.0 110.288 172.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.5 t -134.55 -50.65 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 124.15 0.98 . . . . 0.0 111.989 178.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.2 m -111.9 3.74 17.77 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.399 1.079 . . . . 0.0 113.829 -173.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.3 m -116.28 -3.6 11.95 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -164.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.43 131.97 34.15 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.212 1.005 . . . . 0.0 112.556 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.2 t -153.79 170.0 22.0 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.943 1.697 . . . . 0.0 109.902 171.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.63 -31.77 72.68 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -156.22 154.03 26.52 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 126.986 2.114 . . . . 0.0 112.838 173.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -81.94 69.53 7.54 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.325 3.35 . . . . 0.0 112.213 -175.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -126.91 87.44 2.65 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.237 1.415 . . . . 0.0 111.16 -175.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 74.3 mt -66.75 -52.51 33.17 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.61 1.164 . . . . 0.0 114.117 169.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 C--O 1.252 1.221 0 C-N-CA 124.113 3.209 . . . . 0.0 112.896 174.353 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 112.109 -0.396 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 21.0 m 52.76 41.38 31.58 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 125.738 1.615 . . . . 0.0 114.746 174.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -74.16 112.83 10.69 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.85 0.86 . . . . 0.0 112.199 -172.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 86.5 mtp -134.42 89.59 2.57 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.987 1.715 . . . . 0.0 109.38 174.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -158.49 117.26 3.05 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.391 1.876 . . . . 0.0 108.074 175.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 34.2 t -137.52 -49.2 0.59 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.129 1.372 . . . . 0.0 112.451 169.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.2 mtt -74.91 -13.63 60.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -170.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -113.96 12.36 18.03 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 127.011 2.125 . . . . 0.0 111.643 174.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.42 42.04 0.9 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.749 1.62 . . . . 0.0 111.71 -162.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tp -135.6 2.99 2.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -87.04 -32.63 19.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -164.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -131.64 15.17 4.91 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.35 1.46 . . . . 0.0 113.731 -175.03 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 25.9 mm -73.21 131.47 34.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 125.053 1.341 . . . . 0.0 111.684 -171.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.3 tp -150.27 126.87 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 110.744 171.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -162.4 159.25 25.01 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.618 1.567 . . . . 0.0 112.045 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.1 pm0 -90.58 178.31 6.12 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.645 1.178 . . . . 0.0 113.058 168.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.5 tp -113.13 13.89 8.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.973 0 C-N-CA 126.971 2.108 . . . . 0.0 113.64 -173.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -140.54 160.1 40.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.774 1.63 . . . . 0.0 112.257 -170.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -82.2 8.56 10.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.029 1.332 . . . . 0.0 113.946 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -100.84 141.03 34.3 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.948 1.699 . . . . 0.0 110.755 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -147.32 -82.07 0.13 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.66 1.584 . . . . 0.0 112.16 174.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 95.2 mt -123.96 4.26 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.968 1.707 . . . . 0.0 111.96 -171.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -91.59 0.52 57.49 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.642 -1.286 . . . . 0.0 113.87 -173.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.0 p -122.76 -49.89 1.98 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.273 1.429 . . . . 0.0 112.931 -174.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -65.53 -27.35 68.39 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.369 1.468 . . . . 0.0 114.542 177.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.5 t -89.07 -26.04 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 125.141 1.376 . . . . 0.0 111.895 175.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.6 t -125.95 75.2 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.447 1.499 . . . . 0.0 110.229 -173.102 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -124.92 143.2 50.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.639 1.576 . . . . 0.0 111.651 -177.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -113.21 16.44 19.12 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 125.714 1.606 . . . . 0.0 114.312 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -135.11 60.17 38.22 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 124.786 1.235 . . . . 0.0 112.988 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -81.92 56.35 5.83 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.556 2.837 . . . . 0.0 112.48 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -133.81 -82.38 0.46 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.428 1.491 . . . . 0.0 112.558 -169.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.9 t -141.07 100.12 6.49 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 124.778 1.231 . . . . 0.0 110.452 -174.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -79.9 157.98 24.17 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.93 2.42 . . . . 0.0 113.248 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.6 p -79.27 59.8 2.92 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.255 2.622 . . . . 0.0 113.682 -173.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -86.77 16.19 5.04 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -170.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.03 63.07 7.14 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 126.257 1.823 . . . . 0.0 111.822 -163.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.8 t -142.23 10.89 1.93 Allowed 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 114.56 1.319 . . . . 0.0 114.56 -171.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.26 -45.37 70.65 Favored Glycine 0 CA--C 1.538 1.474 0 O-C-N 120.705 -1.247 . . . . 0.0 115.204 -171.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -131.91 -55.36 0.99 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.965 1.306 . . . . 0.0 112.159 -178.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.3 mp -110.66 114.16 27.32 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 127.258 2.223 . . . . 0.0 108.398 177.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.6 p -98.01 -71.16 0.7 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.375 1.07 . . . . 0.0 111.869 172.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -159.69 -29.05 0.06 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -170.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -85.86 -28.92 24.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.165 0.586 . . . . 0.0 110.684 173.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -78.03 -39.32 42.38 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.242 -0.911 . . . . 0.0 111.257 -167.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -68.34 -29.92 68.76 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.746 0.818 . . . . 0.0 112.566 171.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.11 -7.62 13.11 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -103.29 -56.47 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.956 1.302 . . . . 0.0 109.763 167.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -66.6 -55.84 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.753 1.16 . . . . 0.0 112.198 -173.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.92 78.93 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.739 -0.601 . . . . 0.0 111.253 -176.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -60.03 -42.72 95.0 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 170.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.21 -36.13 76.94 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.309 1.044 . . . . 0.0 112.047 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -58.81 -35.62 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 O-C-N 120.859 -1.151 . . . . 0.0 111.399 174.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.6 m -70.45 -12.3 61.49 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 173.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -91.69 -43.73 9.42 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.14 1.337 . . . . 0.0 112.178 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.1 -10.71 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -165.56 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 125.02 -79.36 0.36 Allowed Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.714 1.149 . . . . 0.0 111.696 170.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -171.23 -43.84 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.559 1.944 . . . . 0.0 111.438 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -106.73 -12.04 15.64 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.996 1.719 . . . . 0.0 114.667 -167.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -90.12 -21.7 22.13 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -175.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.07 164.59 8.2 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.664 1.186 . . . . 0.0 113.224 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.97 164.9 12.87 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.383 1.087 . . . . 0.0 112.139 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.88 -29.38 44.39 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.707 1.203 . . . . 0.0 113.269 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -59.81 -43.58 94.42 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 0.0 111.767 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.92 -25.81 65.66 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.637 -1.29 . . . . 0.0 113.545 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.75 -50.32 17.79 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.978 0.808 . . . . 0.0 111.445 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.3 p -59.94 -26.06 65.67 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -76.24 -26.79 56.37 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 114.074 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 78.8 mtt85 -113.87 -39.35 4.0 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.078 1.351 . . . . 0.0 113.112 -172.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 tt -84.08 -19.35 34.45 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.404 1.881 . . . . 0.0 111.112 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 60.32 72.71 0.51 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.706 2.002 . . . . 0.0 112.473 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.8 pt -135.28 164.4 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 127.367 2.267 . . . . 0.0 110.356 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.5 m -62.9 140.35 58.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.739 1.216 . . . . 0.0 109.913 166.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.9 t -57.54 -38.65 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 O-C-N 121.483 -0.76 . . . . 0.0 111.436 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.06 -26.79 60.59 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.447 -0.783 . . . . 0.0 113.102 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.39 -37.54 80.47 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 118.104 -0.95 . . . . 0.0 110.597 167.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.0 -47.51 74.24 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.286 0.948 . . . . 0.0 111.54 176.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.74 -43.77 85.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.931 1.292 . . . . 0.0 112.498 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -84.62 -34.34 23.13 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -55.37 -48.36 74.4 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.376 1.07 . . . . 0.0 111.266 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.7 mt -46.13 -59.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.752 1.221 . . . . 0.0 110.472 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -87.5 -3.22 59.0 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -172.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -98.79 -34.58 10.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.256 0.935 . . . . 0.0 112.66 170.596 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.8 m -92.45 -27.94 17.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.678 1.191 . . . . 0.0 113.348 -178.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -148.03 70.49 1.15 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.116 1.366 . . . . 0.0 111.668 178.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.0 ttp85 -66.71 -39.73 88.17 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -173.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 61.1 mtt -131.17 -22.5 2.53 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.521 1.128 . . . . 0.0 113.778 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.86 -117.74 0.49 Allowed Glycine 0 N--CA 1.47 0.934 0 CA-C-N 118.758 0.708 . . . . 0.0 111.719 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -70.92 -93.37 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.37 0.668 . . . . 0.0 109.477 161.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.31 47.99 1.12 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 178.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.4 m120 55.44 24.0 6.33 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 116.644 2.09 . . . . 0.0 116.644 168.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -108.77 -0.51 19.92 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.384 1.474 . . . . 0.0 114.038 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -76.28 19.68 0.24 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.847 1.659 . . . . 0.0 114.671 -175.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt -93.51 -2.11 54.78 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 127.103 2.161 . . . . 0.0 114.262 -162.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.1 m -148.33 -46.04 0.15 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.936 2.494 . . . . 0.0 108.763 -170.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.3 pt -73.07 161.2 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 111.424 169.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.6 mptt 61.38 18.79 9.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.526 1.53 . . . . 0.0 114.812 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 38.8 mtt -124.67 -44.96 1.94 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.833 1.253 . . . . 0.0 113.172 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -115.77 27.33 9.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.664 1.586 . . . . 0.0 112.074 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -137.37 160.94 37.66 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.199 1.8 . . . . 0.0 112.075 -167.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -88.97 152.57 21.63 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.653 1.181 . . . . 0.0 112.631 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -146.53 149.92 34.55 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.222 1.409 . . . . 0.0 112.368 178.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.9 t -139.99 -51.99 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.276 1.43 . . . . 0.0 111.131 177.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.2 m -121.4 20.04 11.26 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.258 1.423 . . . . 0.0 112.958 -176.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t -139.16 33.73 2.12 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.644 1.578 . . . . 0.0 112.966 -173.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -147.84 163.83 35.55 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.532 1.533 . . . . 0.0 112.204 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 66.6 m -143.41 140.12 30.28 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.776 1.63 . . . . 0.0 110.429 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 51.26 34.92 12.39 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.779 1.232 . . . . 0.0 113.807 -173.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -120.04 95.63 49.16 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 126.413 1.885 . . . . 0.0 111.218 -175.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -81.01 55.21 5.59 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 124.538 3.492 . . . . 0.0 111.89 -179.312 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -82.91 60.59 5.49 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.567 1.547 . . . . 0.0 112.113 -171.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -118.61 93.2 45.49 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 126.193 1.797 . . . . 0.0 110.492 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 C--O 1.254 1.276 0 C-N-CA 123.821 3.014 . . . . 0.0 113.349 -179.897 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 28.3 p -146.84 157.86 43.77 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.475 1.51 . . . . 0.0 112.37 178.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 67.8 t60 -148.18 144.09 27.49 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.858 1.263 . . . . 0.0 111.03 170.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 66.2 mtt -128.92 97.14 4.55 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.104 1.362 . . . . 0.0 110.72 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.78 101.8 2.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.925 1.69 . . . . 0.0 109.716 175.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.7 t -111.49 0.82 16.64 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.244 1.418 . . . . 0.0 114.003 -175.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.9 mtt -136.58 -5.0 2.01 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -170.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -128.19 10.72 6.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.893 1.677 . . . . 0.0 112.016 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.16 27.27 0.69 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.232 1.413 . . . . 0.0 112.304 -162.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.2 17.08 3.44 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -167.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -135.97 -18.15 1.6 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -167.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -88.96 29.43 1.04 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.228 1.811 . . . . 0.0 114.278 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.8 mp -76.92 97.51 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.475 1.11 . . . . 0.0 110.321 -178.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.5 mt -139.08 139.79 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 126.022 1.729 . . . . 0.0 109.641 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -105.73 112.08 25.01 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.976 1.31 . . . . 0.0 110.16 171.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -158.04 170.2 22.83 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.277 1.431 . . . . 0.0 111.277 -179.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 43.4 pt -118.93 116.95 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 125.967 1.707 . . . . 0.0 110.668 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -143.49 173.48 11.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.529 2.332 . . . . 0.0 110.698 -167.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -74.9 67.5 1.67 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.218 1.007 . . . . 0.0 111.18 166.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -67.41 107.05 2.3 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.892 1.277 . . . . 0.0 110.753 175.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.07 -78.02 0.58 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.649 1.18 . . . . 0.0 112.213 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.9 mt -116.17 -8.54 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -170.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -78.49 -14.82 59.18 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 -177.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.0 t -92.41 -39.65 11.31 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.134 0.974 . . . . 0.0 113.224 -168.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -71.28 -14.81 62.34 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.7 t -74.17 -27.37 21.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.458 1.503 . . . . 0.0 111.805 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.2 t -129.04 80.45 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 125.371 1.468 . . . . 0.0 109.143 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.6 tp -130.97 143.34 50.65 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.272 1.429 . . . . 0.0 111.502 -175.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -115.79 27.07 9.54 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.171 1.788 . . . . 0.0 113.332 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -129.39 56.02 21.72 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 125.299 1.44 . . . . 0.0 113.149 179.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -78.34 56.55 5.87 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 124.137 3.225 . . . . 0.0 113.884 -172.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -79.71 -54.07 6.21 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.031 1.333 . . . . 0.0 112.183 174.596 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t 45.75 106.97 0.01 OUTLIER Pre-proline 0 N--CA 1.477 0.912 0 C-N-CA 129.098 2.959 . . . . 0.0 114.378 -171.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -71.5 165.74 31.54 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.604 2.203 . . . . 0.0 113.263 -178.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.7 p -78.05 43.53 0.44 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.483 2.313 . . . . 0.0 114.94 -168.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -134.21 21.42 3.74 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.462 1.653 . . . . 0.0 115.462 -175.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.442 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 5.8 mmpt? -75.78 66.95 2.14 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.184 1.794 . . . . 0.0 111.922 173.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 t -115.64 8.39 15.01 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.036 1.734 . . . . 0.0 113.434 179.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 84.6 -0.18 89.24 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 125.328 1.442 . . . . 0.0 116.331 173.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -92.71 -48.11 6.75 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 119.623 1.712 . . . . 0.0 113.671 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 mp -146.94 121.99 10.09 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.16 1.384 . . . . 0.0 111.752 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.4 m -102.71 -72.36 0.69 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.493 1.517 . . . . 0.0 112.227 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -162.47 -44.39 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.176 0.59 . . . . 0.0 111.498 -173.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -61.26 -33.78 74.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.588 0.755 . . . . 0.0 110.916 170.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -68.77 -37.58 79.45 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.626 1.171 . . . . 0.0 111.645 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt -66.32 -35.21 79.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.146 -0.972 . . . . 0.0 112.831 171.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -65.06 -1.33 2.04 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 171.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.6 mt -113.58 -14.39 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 126.354 1.862 . . . . 0.0 112.098 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -124.73 -58.96 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.124 0.97 . . . . 0.0 112.642 -174.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.15 -37.75 86.38 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.423 1.011 . . . . 0.0 111.089 175.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.21 -32.03 73.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.713 0.805 . . . . 0.0 113.049 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -77.51 -38.4 48.97 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.027 0.931 . . . . 0.0 111.871 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.14 -33.05 52.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.7 1.2 . . . . 0.0 110.462 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -71.14 -16.38 62.55 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 171.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -104.79 -42.91 5.24 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.681 -1.262 . . . . 0.0 113.024 -171.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.2 m -127.61 -13.21 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -172.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -82.52 0.31 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 125.056 1.313 . . . . 0.0 112.195 168.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 tt -171.75 -43.86 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 111.342 -178.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -112.26 -4.08 14.44 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.003 1.721 . . . . 0.0 114.932 -168.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -93.37 -22.3 19.02 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 112.792 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 pp -66.77 165.72 14.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.946 1.298 . . . . 0.0 112.313 164.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -118.24 172.53 7.38 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.394 1.093 . . . . 0.0 111.599 171.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.0 58.0 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.686 1.194 . . . . 0.0 112.815 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -65.42 -48.06 74.11 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.729 1.611 . . . . 0.0 112.194 -173.739 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -66.47 -29.57 69.72 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.734 -1.229 . . . . 0.0 112.686 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.29 -46.97 25.43 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.326 1.45 . . . . 0.0 110.293 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.6 p -67.89 -29.3 68.37 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.02 1.328 . . . . 0.0 113.469 177.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -66.81 -39.4 87.72 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.866 1.266 . . . . 0.0 112.675 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 83.4 mtt85 -86.99 -42.08 13.4 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.384 1.074 . . . . 0.0 113.28 -179.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 tt -81.26 -18.35 46.27 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.129 1.372 . . . . 0.0 111.829 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 62.67 68.3 0.66 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.604 1.961 . . . . 0.0 112.08 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.1 pt -135.41 177.63 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 127.231 2.213 . . . . 0.0 110.833 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.7 m -73.15 144.4 46.92 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.703 1.601 . . . . 0.0 109.813 166.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.7 t -58.79 -39.89 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 O-C-N 121.442 -0.786 . . . . 0.0 111.434 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -69.63 -30.29 67.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.0 mmtt -64.5 -38.42 90.97 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.161 170.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.61 -48.26 64.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.909 0.777 . . . . 0.0 110.216 175.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -56.34 -42.63 78.04 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.837 1.255 . . . . 0.0 112.891 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 t -82.21 -38.11 25.04 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -61.59 -36.8 81.72 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.861 -1.149 . . . . 0.0 112.937 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.3 mt -49.84 -45.77 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.154 0.981 . . . . 0.0 111.191 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -93.31 -13.0 28.71 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.259 1.578 . . . . 0.0 115.259 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -82.92 -32.02 27.45 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.843 1.201 . . . . 0.0 112.409 169.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -84.42 -47.34 10.77 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.396 1.078 . . . . 0.0 112.821 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -102.82 -29.01 11.72 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -173.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.09 37.8 22.46 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 127.046 2.138 . . . . 0.0 114.471 175.084 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 15.9 mmt 62.74 -45.75 0.19 Allowed 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 128.021 2.528 . . . . 0.0 115.448 -173.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 112.65 -58.0 0.42 Allowed Glycine 0 N--CA 1.467 0.718 0 C-N-CA 127.099 2.285 . . . . 0.0 111.13 168.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -136.93 68.26 1.43 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.594 1.558 . . . . 0.0 111.316 173.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 57.3 p 55.71 32.15 18.82 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.135 1.774 . . . . 0.0 114.334 165.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -75.95 -5.28 45.47 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.62 1.568 . . . . 0.0 112.228 -171.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.94 -20.15 66.11 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 128.712 2.805 . . . . 0.0 113.592 173.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -66.66 12.56 0.07 Allowed 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.949 2.203 . . . . 0.0 116.949 -172.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -5.58 59.32 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 -169.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.7 m -139.0 -47.44 0.48 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.445 1.498 . . . . 0.0 110.806 -167.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 pt -71.12 165.1 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 124.192 0.997 . . . . 0.0 111.828 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? 65.24 -14.45 0.11 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 126.787 2.035 . . . . 0.0 116.417 176.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 49.4 mtm -85.21 -43.55 13.69 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.787 1.176 . . . . 0.0 112.783 -176.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -103.75 -7.6 20.48 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -176.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.1 100.21 10.37 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.59 1.156 . . . . 0.0 110.757 -173.564 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -152.93 163.97 38.8 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.32 1.448 . . . . 0.0 111.618 -175.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -72.12 143.81 48.86 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.466 1.107 . . . . 0.0 112.495 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -128.89 -51.15 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.689 1.195 . . . . 0.0 111.253 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 58.5 p -103.87 -4.31 23.67 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.067 1.347 . . . . 0.0 114.128 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.5 m -100.86 -3.15 30.34 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -171.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.9 148.82 31.12 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.344 1.058 . . . . 0.0 112.891 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.2 m -151.2 135.71 17.02 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.84 1.656 . . . . 0.0 109.775 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 51.26 35.21 13.06 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.48 1.112 . . . . 0.0 113.924 -174.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -124.44 148.67 59.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.266 1.827 . . . . 0.0 111.903 177.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -68.83 115.71 4.09 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.353 2.702 . . . . 0.0 110.988 178.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -143.55 51.99 1.34 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.763 1.225 . . . . 0.0 111.789 -173.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 95.9 mt -120.48 76.27 25.97 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.651 1.58 . . . . 0.0 111.037 -178.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 C--O 1.253 1.232 0 C-N-CA 124.043 3.162 . . . . 0.0 113.231 178.658 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 53.5 m -129.52 153.24 48.21 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.542 1.537 . . . . 0.0 111.872 -177.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -123.61 49.01 1.77 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.019 1.327 . . . . 0.0 111.987 -173.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 98.4 mmm -88.41 84.57 6.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.379 1.072 . . . . 0.0 110.775 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.0 14.76 5.23 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -173.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 59.9 m -91.21 1.24 57.25 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -169.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 ptp -150.63 -4.61 0.32 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -114.87 -8.07 12.58 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.535 1.534 . . . . 0.0 112.87 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.77 21.83 2.31 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.039 1.736 . . . . 0.0 111.662 -165.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -112.18 110.95 21.51 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.253 1.421 . . . . 0.0 109.662 173.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -147.64 23.9 1.11 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.208 1.403 . . . . 0.0 112.747 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 51.03 61.83 3.03 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.574 1.949 . . . . 0.0 114.338 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.4 mp -93.71 56.54 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 125.114 1.366 . . . . 0.0 110.839 -170.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.5 mt -117.98 108.53 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 125.118 1.367 . . . . 0.0 109.333 -176.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -152.84 -57.02 0.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.427 1.091 . . . . 0.0 111.945 177.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -153.01 147.66 26.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.335 1.454 . . . . 0.0 111.322 178.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 33.6 pt -138.82 140.06 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 127.146 2.178 . . . . 0.0 109.164 172.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.66 -72.86 0.24 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.847 1.259 . . . . 0.0 112.158 177.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -145.83 -34.88 0.3 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.667 1.987 . . . . 0.0 112.625 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -128.14 124.91 38.06 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.266 1.426 . . . . 0.0 111.56 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -146.33 -65.03 0.3 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.898 0.879 . . . . 0.0 112.37 168.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.5 tt -91.19 -21.11 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -168.012 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 -69.8 -15.14 63.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.88 -171.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 t -64.47 -29.81 70.85 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.573 1.149 . . . . 0.0 112.393 173.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -83.32 -30.75 27.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.978 0.911 . . . . 0.0 112.443 174.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.0 t -76.35 -44.97 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 124.831 1.252 . . . . 0.0 111.063 -173.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.4 t -99.72 71.51 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.053 1.341 . . . . 0.0 109.18 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.0 tp -142.65 155.25 44.9 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.849 1.26 . . . . 0.0 112.302 -172.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -100.41 25.29 7.81 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 126.346 1.859 . . . . 0.0 113.621 -171.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.22 54.9 16.35 Favored Pre-proline 0 CA--C 1.559 1.314 0 C-N-CA 126.746 2.018 . . . . 0.0 114.769 -176.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.42 89.47 0.94 Allowed 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.632 2.888 . . . . 0.0 111.324 179.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? 51.92 65.13 1.59 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 126.211 1.805 . . . . 0.0 112.362 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.9 t -116.35 95.68 45.92 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.404 1.482 . . . . 0.0 110.159 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -79.7 172.99 13.51 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 123.848 3.032 . . . . 0.0 112.879 172.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.7 p -130.04 72.3 1.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.429 1.492 . . . . 0.0 112.328 -161.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -108.15 19.2 20.24 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -171.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.58 41.27 0.62 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.852 2.061 . . . . 0.0 112.501 -176.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.6 t -129.45 9.48 5.57 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 125.191 1.396 . . . . 0.0 114.649 -164.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.65 12.35 41.41 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.338 1.447 . . . . 0.0 115.902 -175.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -123.18 48.32 1.84 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.516 1.526 . . . . 0.0 112.759 -168.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 62.56 70.94 0.54 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.981 2.112 . . . . 0.0 113.424 171.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.5 t -127.72 78.96 1.86 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.041 1.737 . . . . 0.0 111.585 -161.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 59.34 18.73 6.98 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.493 1.917 . . . . 0.0 116.105 166.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -144.58 -38.88 0.28 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.124 1.77 . . . . 0.0 110.916 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -67.03 -47.2 72.14 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.298 -0.876 . . . . 0.0 111.678 -178.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -65.78 -25.77 67.41 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.86 -1.15 . . . . 0.0 113.125 171.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -69.01 -11.04 60.42 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 169.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.0 mt -95.46 -51.49 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.114 1.365 . . . . 0.0 109.82 165.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.48 -60.05 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.569 0.748 . . . . 0.0 111.829 -169.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.0 -28.55 65.6 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.167 0.44 . . . . 0.0 111.659 -176.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.28 -43.44 87.98 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 165.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -38.36 88.97 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.173 0.897 . . . . 0.0 111.836 174.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.1 mm -57.05 -35.02 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 120.473 -1.392 . . . . 0.0 111.076 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -75.61 -8.41 56.7 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.385 1.624 . . . . 0.0 115.385 173.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.51 -53.43 4.06 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.473 1.488 . . . . 0.0 111.956 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.1 m -120.77 -13.93 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 -165.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.41 -75.25 0.43 Allowed Glycine 0 N--CA 1.469 0.854 0 C-N-CA 124.57 1.081 . . . . 0.0 112.998 164.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 51.4 tp -164.94 -43.57 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.656 1.182 . . . . 0.0 112.215 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -112.4 -5.35 14.11 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.944 1.298 . . . . 0.0 114.393 -168.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -92.93 -15.1 26.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.125 0.97 . . . . 0.0 113.212 -174.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -68.25 166.42 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 166.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -115.82 167.58 10.81 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 122.48 1.133 . . . . 0.0 111.789 170.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.38 -22.89 38.02 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.402 1.081 . . . . 0.0 112.577 -179.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -66.1 -49.57 67.09 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.777 1.631 . . . . 0.0 111.441 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -64.06 -43.79 94.4 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.049 -1.032 . . . . 0.0 111.917 178.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -55.98 -58.48 7.74 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.642 0.777 . . . . 0.0 111.386 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.7 p -61.36 -21.33 63.94 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -78.81 -43.15 25.93 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.897 1.279 . . . . 0.0 112.345 175.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -79.7 -34.12 40.45 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.945 1.298 . . . . 0.0 113.234 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.8 mt -87.31 -23.8 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.955 1.702 . . . . 0.0 113.548 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.17 49.16 9.54 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.083 1.353 . . . . 0.0 112.262 -174.071 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.9 pt -107.24 172.44 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 126.738 2.015 . . . . 0.0 110.712 169.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 m -71.38 137.93 48.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.283 1.433 . . . . 0.0 109.538 165.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -56.28 -38.83 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.778 0.831 . . . . 0.0 111.672 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -72.92 -22.18 60.77 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -75.23 -37.07 61.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.696 166.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.9 -47.81 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.387 0.54 . . . . 0.0 110.813 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -51.46 -37.17 47.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.313 1.845 . . . . 0.0 113.567 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.5 t -96.26 -30.64 13.34 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -63.85 -32.37 73.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.003 -1.061 . . . . 0.0 112.499 174.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 33.2 mt -50.92 -27.11 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.54 1.536 . . . . 0.0 112.791 173.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -115.34 -26.02 7.76 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 176.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -80.89 35.14 0.36 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.906 1.282 . . . . 0.0 112.542 171.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.1 t -157.47 -48.82 0.07 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.137 1.375 . . . . 0.0 112.727 177.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -135.62 28.43 3.3 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -161.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.6 ptt-85 -75.21 -10.72 59.72 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 -177.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 9.4 ttp -142.31 60.03 1.45 Allowed 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.618 0.723 . . . . 0.0 112.809 -169.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -81.19 -106.82 0.33 Allowed Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.523 1.058 . . . . 0.0 111.697 174.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -100.61 52.23 0.87 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.086 1.355 . . . . 0.0 112.354 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.5 p 52.76 19.46 1.28 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.531 1.678 . . . . 0.0 115.531 170.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 50.85 15.01 0.21 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.434 1.893 . . . . 0.0 115.193 -164.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -14.21 58.97 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 120.018 -1.676 . . . . 0.0 113.378 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -73.88 14.94 0.33 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.841 2.056 . . . . 0.0 114.167 176.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -81.43 5.05 18.82 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.835 2.454 . . . . 0.0 114.436 -173.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 51.5 m -144.55 -46.59 0.25 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 127.066 2.146 . . . . 0.0 110.097 -170.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.5 mt -70.72 159.65 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.938 1.295 . . . . 0.0 109.223 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.5 mmtp 67.73 0.85 2.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.655 1.982 . . . . 0.0 116.211 177.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.9 mtm -106.66 -42.63 4.92 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.22 -21.48 31.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.792 0.837 . . . . 0.0 113.117 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -86.13 137.85 32.36 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.246 1.818 . . . . 0.0 110.939 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -135.77 155.64 50.05 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.724 1.61 . . . . 0.0 112.0 -176.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -106.92 140.1 40.27 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.482 1.513 . . . . 0.0 111.553 172.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.0 t -129.53 -39.34 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 124.824 1.25 . . . . 0.0 111.028 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 77.5 p -121.2 15.21 11.43 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.187 1.795 . . . . 0.0 113.707 -178.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 7.8 t 58.04 86.52 0.08 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.108 1.763 . . . . 0.0 112.718 -171.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.67 171.24 15.41 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.415 1.486 . . . . 0.0 113.885 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.0 m -108.8 172.7 6.69 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.625 1.57 . . . . 0.0 110.632 176.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.55 -26.41 65.35 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -146.0 151.64 45.66 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 126.891 2.076 . . . . 0.0 110.69 167.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.32 129.46 18.11 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.143 2.562 . . . . 0.0 110.424 169.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -135.27 43.73 2.63 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.325 1.45 . . . . 0.0 111.641 -175.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 18.8 tp -132.71 66.41 76.5 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 125.032 1.333 . . . . 0.0 111.417 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.253 1.252 0 C-N-CA 123.939 3.093 . . . . 0.0 113.317 179.325 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.492 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.8 m -137.86 152.19 48.82 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.345 1.458 . . . . 0.0 111.579 -177.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 57.2 t60 -100.74 136.22 40.95 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.661 1.184 . . . . 0.0 111.176 177.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 94.2 mtp -133.61 102.12 5.37 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.185 1.394 . . . . 0.0 110.395 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.4 -65.27 0.43 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.801 1.24 . . . . 0.0 111.831 175.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 21.4 m 51.76 35.93 16.51 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.536 1.534 . . . . 0.0 114.584 178.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ptm -155.46 -33.29 0.09 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 -176.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -93.19 -10.26 36.4 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.011 1.324 . . . . 0.0 113.166 -175.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.49 19.47 3.35 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.402 1.881 . . . . 0.0 111.872 -168.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.0 mp -116.81 129.41 56.08 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.661 1.585 . . . . 0.0 110.342 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -145.68 5.88 1.05 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.438 1.095 . . . . 0.0 113.792 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -110.76 91.27 3.59 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.652 1.581 . . . . 0.0 110.279 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -132.36 104.53 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 125.029 1.331 . . . . 0.0 109.059 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.1 mp -138.36 128.27 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.341 1.456 . . . . 0.0 109.595 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 50.06 44.16 25.74 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.654 1.582 . . . . 0.0 113.468 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -141.06 172.09 13.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.871 1.668 . . . . 0.0 112.044 -173.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.326 14.9 tt 50.84 41.05 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 126.4 1.88 . . . . 0.0 114.391 168.015 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.52 169.03 12.56 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.955 1.302 . . . . 0.0 112.273 177.072 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -75.37 64.88 1.59 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.894 1.278 . . . . 0.0 111.26 169.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -75.77 97.77 3.96 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 124.934 1.294 . . . . 0.0 110.756 176.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.12 -70.94 0.38 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.125 0.97 . . . . 0.0 112.092 175.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 mt -118.63 3.43 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.629 1.572 . . . . 0.0 112.179 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -81.25 -7.22 59.53 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.4 t -101.18 -55.03 2.65 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.665 1.186 . . . . 0.0 112.991 178.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -71.7 -16.46 62.24 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -168.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 71.2 t -74.41 -26.96 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.861 1.264 . . . . 0.0 112.024 178.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.6 t -96.6 47.15 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.908 1.283 . . . . 0.0 111.408 -175.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.4 mt -138.63 145.02 39.99 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.217 1.807 . . . . 0.0 111.553 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -133.49 36.9 3.35 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.879 1.672 . . . . 0.0 112.764 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.0 t30 52.01 75.83 0.61 Allowed Pre-proline 0 CA--C 1.556 1.174 0 C-N-CA 126.799 2.04 . . . . 0.0 112.921 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.82 76.72 3.61 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 124.17 3.247 . . . . 0.0 112.925 -171.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.76 43.43 28.1 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 126.969 2.107 . . . . 0.0 113.421 174.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 43.1 t 41.77 89.51 0.08 OUTLIER Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 129.118 2.967 . . . . 0.0 113.321 -178.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -69.16 165.47 30.17 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 122.457 2.105 . . . . 0.0 113.45 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.7 p -128.96 71.9 1.44 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.331 1.452 . . . . 0.0 111.917 -155.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -127.85 17.23 6.81 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -170.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.63 72.22 6.79 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.797 1.639 . . . . 0.0 110.772 -170.687 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.4 t -141.68 11.6 2.07 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 114.795 1.405 . . . . 0.0 114.795 -170.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.0 -79.24 0.92 Allowed Glycine 0 CA--C 1.533 1.178 0 O-C-N 120.78 -1.2 . . . . 0.0 112.728 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 63.08 -3.05 0.37 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 127.996 2.519 . . . . 0.0 115.64 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp -144.13 141.44 29.99 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 127.098 2.159 . . . . 0.0 109.69 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.3 t -113.25 -73.09 0.68 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.268 1.827 . . . . 0.0 112.043 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -161.86 -45.86 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.28 0.632 . . . . 0.0 111.19 -171.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.69 -32.23 73.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.534 0.734 . . . . 0.0 111.124 173.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -67.79 -35.36 78.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.129 0.972 . . . . 0.0 111.601 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -69.69 -35.07 74.76 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.295 -0.878 . . . . 0.0 112.667 171.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.71 -5.98 3.2 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.27 -24.56 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.81 1.644 . . . . 0.0 112.382 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.433 HG22 HD22 ' A' ' 60' ' ' LEU . 51.2 t -112.75 -59.59 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 124.597 1.159 . . . . 0.0 112.598 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.26 -33.11 73.99 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.269 -0.894 . . . . 0.0 111.893 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -68.71 -30.85 69.58 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.182 0.993 . . . . 0.0 113.208 171.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -76.65 -37.85 55.57 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.873 1.269 . . . . 0.0 111.623 177.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.47 -40.0 65.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 O-C-N 121.062 -1.023 . . . . 0.0 110.085 167.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -73.11 -6.22 44.24 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -110.03 -30.96 7.55 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.331 1.423 . . . . 0.0 113.261 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.1 p -135.2 -16.54 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -173.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.96 -83.49 0.28 Allowed Glycine 0 N--CA 1.469 0.886 0 C-N-CA 125.098 1.332 . . . . 0.0 111.683 171.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 tt -166.31 -44.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.082 1.753 . . . . 0.0 110.551 177.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -107.55 -6.73 16.81 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.224 1.81 . . . . 0.0 115.155 -168.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.36 -16.94 24.1 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.911 0.778 . . . . 0.0 112.862 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -63.46 163.76 10.37 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.181 1.392 . . . . 0.0 112.754 167.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -112.69 170.6 8.07 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.233 1.016 . . . . 0.0 111.47 170.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -21.66 31.72 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.424 1.089 . . . . 0.0 112.72 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -65.24 -45.35 85.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.809 1.643 . . . . 0.0 112.219 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -65.46 -36.48 84.0 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.556 -1.34 . . . . 0.0 111.993 176.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.433 HD22 HG22 ' A' ' 43' ' ' VAL . 47.2 mt -65.89 -47.25 75.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.182 0.593 . . . . 0.0 112.146 173.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.8 p -63.9 -31.05 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.11 -0.994 . . . . 0.0 113.036 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -71.47 -43.6 66.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.338 1.455 . . . . 0.0 112.834 176.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -94.78 -37.11 11.41 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -86.28 -15.36 40.95 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.446 1.499 . . . . 0.0 111.568 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 59.82 67.18 0.9 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.244 1.818 . . . . 0.0 112.657 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.1 pt -136.87 161.64 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 128.399 2.68 . . . . 0.0 109.022 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 70' ' ' LYS . 15.3 t -68.4 153.17 44.29 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.364 -0.835 . . . . 0.0 110.751 167.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.99 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.679 0.792 . . . . 0.0 111.126 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.06 -31.5 70.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.407 ' H ' HG23 ' A' ' 67' ' ' THR . 27.7 mttm -64.93 -40.69 95.44 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.62 170.086 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.33 -49.18 65.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.651 0.66 . . . . 0.0 110.64 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -54.35 -42.47 70.29 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.438 1.495 . . . . 0.0 112.483 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -85.15 -38.06 19.47 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.509 0.595 . . . . 0.0 112.526 -178.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -61.74 -35.73 78.93 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.054 -1.029 . . . . 0.0 112.984 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.9 mt -47.69 -55.27 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.194 0.998 . . . . 0.0 110.719 172.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -77.4 -30.32 53.53 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -67.85 -35.02 77.83 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.098 1.317 . . . . 0.0 112.268 175.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.2 t -77.11 -45.91 25.33 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.337 1.055 . . . . 0.0 112.116 178.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -149.53 83.13 1.41 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.446 1.098 . . . . 0.0 112.164 -178.155 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.6 ttp85 -67.51 -61.84 1.7 Allowed 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.844 -1.16 . . . . 0.0 112.545 178.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 51.0 mtt -158.21 39.78 0.26 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.838 2.455 . . . . 0.0 110.242 -171.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -87.77 -125.77 2.26 Favored Glycine 0 CA--C 1.528 0.881 0 O-C-N 120.895 -1.128 . . . . 0.0 111.525 -175.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -94.89 34.43 1.36 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.075 1.75 . . . . 0.0 112.072 175.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 50.75 29.0 3.92 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.918 2.087 . . . . 0.0 113.263 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 44.75 36.73 1.93 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.095 1.758 . . . . 0.0 114.707 -168.322 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.27 -5.65 24.03 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.329 . . . . 0.0 113.851 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -71.63 17.25 0.09 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.634 1.974 . . . . 0.0 114.082 174.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.9 pttt -84.46 -10.4 57.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 128.056 2.542 . . . . 0.0 113.116 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 85.4 m -137.03 -42.7 0.57 Allowed 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.558 1.943 . . . . 0.0 111.24 -175.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.5 mt -71.19 153.42 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.829 0.852 . . . . 0.0 108.881 167.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm 66.68 -4.66 0.72 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 170.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -82.18 -26.89 32.99 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.939 0.79 . . . . 0.0 113.032 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -114.91 -10.67 12.29 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.063 1.345 . . . . 0.0 113.95 -175.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -94.79 149.6 21.07 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.406 1.482 . . . . 0.0 111.988 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -87.9 114.81 24.87 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.802 0.841 . . . . 0.0 110.691 172.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -138.18 145.5 41.57 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.85 1.66 . . . . 0.0 111.36 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 37.8 t -135.98 -50.1 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.681 1.192 . . . . 0.0 111.516 173.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 23.6 m -120.3 24.48 10.37 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.056 1.343 . . . . 0.0 113.324 -175.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t 54.25 49.78 17.84 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.634 1.574 . . . . 0.0 113.678 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.06 165.36 23.68 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.776 1.23 . . . . 0.0 113.275 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.5 t -139.12 -173.02 3.47 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.287 1.435 . . . . 0.0 110.514 176.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.44 56.71 0.68 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.892 1.677 . . . . 0.0 112.621 176.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -71.84 149.32 92.68 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.045 1.738 . . . . 0.0 112.366 -176.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.15 79.19 3.21 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 124.118 3.212 . . . . 0.0 111.283 177.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -140.44 95.41 2.87 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.763 1.625 . . . . 0.0 109.898 -176.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.1 tp -130.88 68.1 81.45 Favored Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 125.381 1.473 . . . . 0.0 111.363 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 C--O 1.254 1.313 0 C-N-CA 124.11 3.207 . . . . 0.0 113.269 179.384 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.581 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 11.2 t -146.79 145.84 30.05 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.103 1.361 . . . . 0.0 111.346 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -148.06 33.16 0.82 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.665 1.186 . . . . 0.0 112.584 -170.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.4 mmt -97.67 76.32 2.49 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.054 1.342 . . . . 0.0 111.377 -172.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.67 73.2 0.33 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.646 1.979 . . . . 0.0 113.735 -178.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 57.5 p -49.42 -34.3 16.15 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.07 2.148 . . . . 0.0 114.76 -174.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.8 mtp -67.47 -10.69 53.88 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.389 1.476 . . . . 0.0 114.276 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -123.57 9.72 9.02 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 127.81 2.444 . . . . 0.0 112.097 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.58 20.66 2.02 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.288 1.835 . . . . 0.0 111.887 -163.565 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 mp -118.58 120.9 38.84 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.61 1.564 . . . . 0.0 110.839 176.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -147.17 2.58 0.77 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.136 1.374 . . . . 0.0 113.343 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -119.47 89.33 3.11 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.156 1.782 . . . . 0.0 109.704 -174.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 28.8 mm -123.57 136.41 60.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.802 1.641 . . . . 0.0 109.52 -174.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.7 mm -96.25 128.92 47.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.207 1.003 . . . . 0.0 110.657 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -139.08 14.26 2.64 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.98 1.312 . . . . 0.0 112.596 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -85.37 169.5 13.63 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -173.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 10.7 tt -93.86 12.61 3.09 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 126.534 1.934 . . . . 0.0 114.115 178.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -141.31 158.37 43.98 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.602 1.561 . . . . 0.0 112.357 -169.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -89.83 36.8 0.86 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.256 1.423 . . . . 0.0 113.162 -177.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -144.18 145.82 32.33 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.635 1.574 . . . . 0.0 111.703 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.83 -96.3 0.11 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.391 1.876 . . . . 0.0 110.192 -166.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.5 mp -136.54 54.29 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.499 1.919 . . . . 0.0 107.862 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -128.28 8.45 6.04 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.779 1.632 . . . . 0.0 112.217 174.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.3 t -134.64 -54.02 0.82 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.492 1.117 . . . . 0.0 112.742 -176.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -60.27 -22.68 63.4 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 175.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.6 p -85.5 -13.51 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.72 2.008 . . . . 0.0 113.302 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.2 t -129.98 52.63 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 125.732 1.613 . . . . 0.0 109.99 173.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.7 tp -89.06 155.85 19.21 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.449 1.1 . . . . 0.0 111.849 178.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.9 24.49 9.6 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.691 1.596 . . . . 0.0 114.883 -171.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.5 t30 51.02 74.46 0.8 Allowed Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 126.452 1.901 . . . . 0.0 113.022 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.74 94.86 0.28 Allowed 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.741 2.961 . . . . 0.0 113.006 -171.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.1 mmt85 -137.55 -43.21 0.54 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.924 2.09 . . . . 0.0 112.69 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.9 t -126.41 86.34 58.45 Favored Pre-proline 0 N--CA 1.479 1.005 0 C-N-CA 124.338 1.055 . . . . 0.0 111.134 -178.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -76.16 173.06 15.11 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.639 2.893 . . . . 0.0 113.155 172.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.8 p -119.94 68.32 0.83 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.073 1.749 . . . . 0.0 112.804 -164.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -113.39 30.04 7.52 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.288 1.435 . . . . 0.0 113.41 -174.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.406 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -75.9 39.91 0.19 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.337 1.855 . . . . 0.0 113.924 -174.621 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.8 t -117.93 -5.34 11.03 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.778 1.631 . . . . 0.0 114.901 -171.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.22 -54.06 7.22 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.623 1.106 . . . . 0.0 113.148 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.07 32.97 22.68 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.883 1.673 . . . . 0.0 114.318 175.034 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.23 96.1 6.18 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.038 1.735 . . . . 0.0 111.317 -170.72 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.2 m -134.05 71.36 1.45 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.662 1.985 . . . . 0.0 111.3 -173.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 66.44 8.76 5.97 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 163.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -128.44 -32.6 2.18 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.27 1.028 . . . . 0.0 111.903 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -76.1 -42.71 46.33 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.978 1.311 . . . . 0.0 111.407 -170.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.25 -31.02 72.06 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.179 0.992 . . . . 0.0 112.846 166.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -68.21 -3.48 10.8 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 169.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -103.54 -55.96 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.287 1.435 . . . . 0.0 109.579 166.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.8 t -74.18 -50.69 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 CA-C-N 119.308 0.958 . . . . 0.0 113.075 -170.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.09 -34.72 78.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.88 0.764 . . . . 0.0 111.084 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.05 -35.52 77.15 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 170.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.51 -39.72 70.6 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.182 -0.949 . . . . 0.0 111.521 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -36.82 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 O-C-N 120.601 -1.312 . . . . 0.0 110.944 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.8 m -70.83 -11.49 60.99 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 171.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -104.48 -42.24 5.5 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.318 1.417 . . . . 0.0 112.873 -172.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.9 m -128.81 -13.36 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.49 -79.2 0.34 Allowed Glycine 0 N--CA 1.47 0.923 0 C-N-CA 125.075 1.322 . . . . 0.0 112.504 164.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 tp -159.8 -47.33 0.05 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.371 1.068 . . . . 0.0 112.143 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -106.34 -13.39 15.39 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.684 1.594 . . . . 0.0 114.307 -170.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -87.16 -11.04 51.15 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -171.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.4 pp -69.9 175.1 4.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.166 1.786 . . . . 0.0 113.975 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -117.68 120.85 39.26 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.083 0.953 . . . . 0.0 111.964 -178.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.11 -24.91 68.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.289 0.636 . . . . 0.0 112.641 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.0 m -69.38 -43.6 73.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.9 1.28 . . . . 0.0 112.1 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -63.51 -38.51 91.4 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.266 -1.521 . . . . 0.0 111.763 173.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.73 -51.29 69.98 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.775 0.43 . . . . 0.0 111.633 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 98.6 p -65.26 -26.8 68.25 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -74.17 -46.44 42.23 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.608 1.563 . . . . 0.0 112.07 175.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.3 mmt-85 -72.8 -42.9 63.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.846 1.258 . . . . 0.0 113.127 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -92.38 -20.34 21.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.102 1.761 . . . . 0.0 112.249 -170.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 62.25 68.17 0.69 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.279 1.832 . . . . 0.0 112.844 -178.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.5 pt -132.35 173.97 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 128.55 2.74 . . . . 0.0 108.527 174.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.423 HG23 ' H ' ' A' ' 70' ' ' LYS . 12.7 t -78.36 152.94 32.04 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 121.126 -0.983 . . . . 0.0 110.573 165.313 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.6 t -57.49 -36.45 53.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.093 0.957 . . . . 0.0 111.134 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.46 -33.8 75.87 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.423 ' H ' HG23 ' A' ' 67' ' ' THR . 43.6 mtmt -69.2 -33.45 73.37 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.049 -0.976 . . . . 0.0 111.396 172.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -49.67 54.26 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.548 1.067 . . . . 0.0 110.679 174.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -55.15 -39.23 69.25 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.439 1.496 . . . . 0.0 112.796 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.6 t -83.88 -41.16 17.73 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -59.93 -34.32 73.08 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 120.862 -1.149 . . . . 0.0 112.835 -179.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.09 -64.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.657 1.183 . . . . 0.0 110.408 171.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.71 -21.98 60.96 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -179.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -79.99 -31.44 39.75 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.081 0.855 . . . . 0.0 112.725 -178.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -94.22 -45.3 7.58 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.159 1.384 . . . . 0.0 112.89 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -126.19 81.27 1.98 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.052 1.341 . . . . 0.0 112.324 -175.185 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.02 -4.03 50.3 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 125.568 1.547 . . . . 0.0 114.554 171.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 69.3 mtm -81.81 59.69 4.36 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.058 1.343 . . . . 0.0 112.731 -172.703 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -88.49 -114.29 1.24 Allowed Glycine 0 CA--C 1.53 1.031 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 169.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.9 mtt85 -109.31 61.55 0.6 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.513 1.525 . . . . 0.0 111.999 172.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.3 p 53.03 23.35 2.89 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 165.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 48.94 25.98 1.21 Allowed 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 125.83 1.652 . . . . 0.0 114.77 -166.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.52 -8.81 28.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.493 1.517 . . . . 0.0 113.805 -178.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -70.9 15.36 0.11 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.367 2.267 . . . . 0.0 115.569 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -77.39 1.87 17.69 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 126.703 2.001 . . . . 0.0 114.756 -172.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.4 m -147.6 -48.89 0.17 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.707 2.003 . . . . 0.0 110.297 -170.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.7 mt -71.31 156.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.649 1.18 . . . . 0.0 109.533 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? 68.23 -4.92 0.97 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.991 2.116 . . . . 0.0 116.118 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.7 mtm -102.99 -43.09 5.61 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -94.11 -9.07 37.74 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -97.21 150.47 20.87 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.325 1.45 . . . . 0.0 112.222 -175.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -138.34 152.52 48.54 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.63 1.572 . . . . 0.0 111.173 176.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -143.17 148.71 36.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.023 1.329 . . . . 0.0 112.1 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.4 t -135.39 -47.24 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.957 1.303 . . . . 0.0 111.205 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.1 m -119.75 26.48 9.31 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.411 1.484 . . . . 0.0 113.169 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.8 t 55.99 38.14 29.62 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.824 1.65 . . . . 0.0 114.328 -179.08 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.37 125.75 29.83 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.179 -0.951 . . . . 0.0 111.805 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.6 m -145.55 118.5 8.77 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.447 1.499 . . . . 0.0 109.876 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.14 24.48 4.89 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.716 1.606 . . . . 0.0 115.176 -177.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -124.58 98.33 37.71 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 125.833 1.653 . . . . 0.0 110.99 -177.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.05 64.52 8.87 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 124.324 3.349 . . . . 0.0 111.641 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.08 38.83 3.56 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.861 1.664 . . . . 0.0 112.023 -172.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 90.7 mt -133.68 150.62 75.29 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.858 1.663 . . . . 0.0 111.495 -179.209 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.235 0 C-N-CA 124.088 3.192 . . . . 0.0 113.426 179.024 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 112.117 -0.393 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 12.2 t -147.5 158.2 43.89 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.501 1.52 . . . . 0.0 111.245 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -118.93 119.19 33.59 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.908 1.283 . . . . 0.0 111.055 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 60.9 mtt -135.4 113.11 10.88 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.174 1.39 . . . . 0.0 110.091 175.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -144.31 -63.78 0.37 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.752 1.221 . . . . 0.0 111.565 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 20.3 m 53.07 31.63 11.56 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.682 1.593 . . . . 0.0 114.93 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.94 -25.64 0.12 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -93.63 -7.51 43.7 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.431 1.492 . . . . 0.0 113.306 -178.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.05 33.75 1.55 Allowed 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.856 1.663 . . . . 0.0 111.587 -164.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.5 mp -104.33 87.43 2.73 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.398 1.479 . . . . 0.0 110.22 -178.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -127.69 -0.81 6.1 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.173 1.389 . . . . 0.0 113.804 -176.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -102.73 89.1 3.38 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.905 1.282 . . . . 0.0 111.971 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 mp -134.57 -47.94 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 178.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 20.2 tt -150.04 149.23 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.955 1.302 . . . . 0.0 111.52 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.7 mp0 -113.0 148.32 35.32 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.456 1.503 . . . . 0.0 111.55 177.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -150.92 156.27 40.85 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.915 1.286 . . . . 0.0 111.172 -177.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.7 pt -85.25 77.07 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.826 1.25 . . . . 0.0 112.777 -176.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -152.21 156.62 40.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.395 1.478 . . . . 0.0 111.734 -174.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -92.85 61.5 3.55 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.697 1.199 . . . . 0.0 111.454 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -134.3 138.11 44.74 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.218 1.007 . . . . 0.0 111.155 174.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.42 -77.45 0.31 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.615 1.566 . . . . 0.0 110.967 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 69.8 mt -121.86 -10.06 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.792 1.237 . . . . 0.0 113.597 -174.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -74.0 -16.13 61.08 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -172.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.1 t -88.71 -53.34 4.67 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.305 1.042 . . . . 0.0 112.136 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -71.08 -18.01 62.57 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.6 t -87.12 -26.83 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.097 1.359 . . . . 0.0 111.963 175.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.6 t -132.08 79.83 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 125.232 1.413 . . . . 0.0 110.155 -174.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.8 tp -132.58 147.97 52.36 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.144 1.378 . . . . 0.0 111.955 -177.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -121.65 42.15 3.17 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.572 1.549 . . . . 0.0 113.322 -175.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 t30 49.8 64.61 8.2 Favored Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 126.469 1.907 . . . . 0.0 114.247 176.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.28 88.53 0.48 Allowed 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.923 3.082 . . . . 0.0 112.159 -176.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -127.25 -50.55 1.42 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.151 1.78 . . . . 0.0 113.501 -178.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 44.6 t 48.25 83.37 0.22 Allowed Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 127.802 2.441 . . . . 0.0 112.978 175.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -66.59 158.86 53.65 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.494 2.796 . . . . 0.0 113.446 -178.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.2 t -113.88 79.73 1.29 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.739 1.615 . . . . 0.0 111.502 -169.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -104.56 32.6 3.98 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.821 1.649 . . . . 0.0 112.781 -178.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.72 33.76 0.08 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 127.152 2.181 . . . . 0.0 115.024 -173.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.0 t -138.23 13.5 2.82 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.137 1.375 . . . . 0.0 114.414 -162.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -146.26 25.82 1.71 Allowed Glycine 0 CA--C 1.535 1.336 0 O-C-N 120.788 -1.195 . . . . 0.0 115.793 -172.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -76.11 -53.19 8.68 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.746 1.273 . . . . 0.0 113.365 -173.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp -145.19 141.84 29.05 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.969 2.108 . . . . 0.0 108.968 174.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.5 m -120.46 -66.76 1.03 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.802 1.641 . . . . 0.0 112.162 177.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -163.6 -48.91 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.0 110.453 -170.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.61 72.89 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.937 177.514 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -68.92 -34.42 75.36 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.185 0.994 . . . . 0.0 111.921 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -69.63 -33.62 72.9 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.88 -1.138 . . . . 0.0 111.847 171.871 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -67.09 -1.16 3.9 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 170.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.1 mt -112.53 -26.86 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.523 1.929 . . . . 0.0 112.44 171.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.2 t -107.95 -59.91 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.749 1.159 . . . . 0.0 112.378 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.37 93.81 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.767 0.827 . . . . 0.0 111.701 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -66.47 -38.44 87.33 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -71.38 -32.05 68.01 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.619 1.168 . . . . 0.0 112.677 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.56 -31.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.08 0.952 . . . . 0.0 111.768 167.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 t -74.71 -17.16 60.7 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.479 0.712 . . . . 0.0 112.86 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -90.61 -44.21 9.68 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.223 -0.923 . . . . 0.0 111.318 176.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 84.9 t -108.12 -48.85 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -167.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.34 -79.84 0.18 Allowed Glycine 0 N--CA 1.469 0.894 0 CA-C-N 118.182 0.446 . . . . 0.0 114.053 170.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 tt -172.63 -39.3 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.805 1.642 . . . . 0.0 113.331 -173.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -121.62 -9.69 8.89 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.616 1.567 . . . . 0.0 114.984 -168.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -3.29 28.09 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -172.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.38 157.43 37.06 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.59 1.956 . . . . 0.0 113.961 -170.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -85.38 104.93 15.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.214 1.006 . . . . 0.0 109.726 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.78 -24.39 61.72 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.347 0.659 . . . . 0.0 112.349 171.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -58.67 -46.03 88.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.426 1.89 . . . . 0.0 112.405 169.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -63.63 -37.64 88.11 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.307 -1.495 . . . . 0.0 112.423 175.57 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.19 -49.82 70.53 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.566 0.621 . . . . 0.0 112.174 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.1 p -64.53 -22.96 67.11 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.235 -0.916 . . . . 0.0 113.468 -179.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -81.76 -14.47 56.41 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.608 1.563 . . . . 0.0 113.751 175.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -119.99 -42.18 2.61 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.227 1.411 . . . . 0.0 113.582 -172.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.1 mp -85.85 -12.01 51.88 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.868 1.267 . . . . 0.0 112.603 172.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.67 63.97 1.55 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.313 1.445 . . . . 0.0 111.905 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -128.22 167.19 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 126.937 2.095 . . . . 0.0 111.45 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.8 m -63.86 141.46 58.76 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.72 1.208 . . . . 0.0 109.721 167.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.74 -36.94 68.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.251 -0.905 . . . . 0.0 111.437 -178.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -72.83 -28.71 62.71 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 177.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -66.05 -40.07 90.63 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.524 -0.75 . . . . 0.0 110.519 168.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.75 -47.82 73.95 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.91 0.777 . . . . 0.0 111.14 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.51 -38.69 69.53 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.451 1.5 . . . . 0.0 112.942 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -88.76 -34.95 16.94 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.96 -34.91 79.05 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.73 1.212 . . . . 0.0 112.884 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.6 mt -50.29 -36.36 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.735 1.214 . . . . 0.0 112.096 173.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -92.01 -43.95 9.14 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.969 0.908 . . . . 0.0 112.799 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 -68.24 -23.54 64.8 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -172.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.1 t -84.89 -37.45 20.59 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.232 1.013 . . . . 0.0 113.509 173.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -145.45 54.23 1.19 Allowed 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -168.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -58.23 -30.96 66.93 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -172.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 61.1 mtm -127.74 -9.87 5.56 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.342 1.457 . . . . 0.0 113.889 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.51 132.49 7.28 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.234 1.397 . . . . 0.0 112.116 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 48.3 33.15 3.58 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 125.945 1.698 . . . . 0.0 113.71 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 46.88 30.66 1.27 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.308 2.243 . . . . 0.0 113.818 -174.399 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 56.5 7.92 0.4 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 126.72 2.008 . . . . 0.0 115.543 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -12.44 59.99 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 119.992 -1.692 . . . . 0.0 113.906 -173.675 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -72.61 13.15 0.39 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 127.085 2.154 . . . . 0.0 114.835 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -91.32 -4.3 55.96 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.727 2.411 . . . . 0.0 114.64 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 63.6 m -138.61 -49.36 0.53 Allowed 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.994 1.718 . . . . 0.0 110.343 -172.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 44.1 pt -70.44 164.67 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.49 1.116 . . . . 0.0 111.873 176.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 65.14 -9.54 0.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 127.263 2.225 . . . . 0.0 116.346 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 46.0 mtm -93.29 -39.49 10.94 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.781 1.173 . . . . 0.0 113.945 -175.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -120.69 0.84 10.49 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -173.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -81.85 109.02 15.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.477 1.111 . . . . 0.0 111.149 -175.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -142.76 156.68 45.03 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.002 1.721 . . . . 0.0 111.547 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -110.6 142.28 42.66 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.184 1.393 . . . . 0.0 111.724 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -131.71 -42.56 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.727 1.211 . . . . 0.0 111.627 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 18.1 t -65.77 -35.57 81.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.616 0.766 . . . . 0.0 112.32 177.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 65.3 m -100.48 113.41 26.18 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.706 1.602 . . . . 0.0 110.542 171.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -150.87 154.03 36.46 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.306 1.443 . . . . 0.0 111.577 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.2 m -142.87 136.78 29.02 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.963 1.305 . . . . 0.0 111.064 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 55.1 16.14 1.47 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.051 1.74 . . . . 0.0 115.596 -177.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -83.05 126.6 72.05 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 124.294 1.037 . . . . 0.0 111.103 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -82.81 56.07 5.5 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.265 3.31 . . . . 0.0 112.504 -175.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -119.46 69.44 0.83 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.559 1.544 . . . . 0.0 111.552 -171.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 93.7 mt -125.7 87.81 55.25 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.8 1.64 . . . . 0.0 110.212 177.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo . . . . . 0 C--O 1.252 1.191 0 C-N-CA 123.915 3.077 . . . . 0.0 113.313 -179.509 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.642 0 N-CA-C 111.566 -0.613 . . . . 0.0 111.566 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 4.4 t -135.06 48.05 2.3 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.82 1.248 . . . . 0.0 112.329 -176.125 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 51.93 43.46 30.22 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.112 1.765 . . . . 0.0 113.409 -179.762 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 80.9 mtp -75.46 111.45 10.77 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.851 1.261 . . . . 0.0 110.145 -178.094 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -143.73 -49.53 0.3 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.215 1.006 . . . . 0.0 113.024 -176.544 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 8.0 t 63.34 -39.1 0.18 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.831 2.852 . . . . 0.0 117.242 176.427 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.6 ptt? -114.26 0.39 14.16 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 -174.471 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -118.77 1.68 11.59 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.426 1.49 . . . . 0.0 114.038 -177.426 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -122.86 13.91 9.93 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.004 1.483 . . . . 0.0 115.004 -171.278 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -83.9 -47.11 11.39 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.051 0.94 . . . . 0.0 113.118 -177.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -105.53 -22.99 12.88 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -173.354 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -115.16 127.79 55.77 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.864 1.665 . . . . 0.0 109.1 172.073 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.1 mp -134.83 120.0 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.684 1.194 . . . . 0.0 109.523 -172.87 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.1 mm -136.06 142.41 38.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 126.341 1.856 . . . . 0.0 109.578 -173.455 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 51.24 60.66 3.71 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.857 1.663 . . . . 0.0 113.675 176.465 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -126.09 -61.21 1.24 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.465 1.106 . . . . 0.0 112.816 -177.384 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 10.3 pt -135.68 111.81 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.247 1.419 . . . . 0.0 110.915 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.5 pm0 -156.06 -176.96 6.23 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.963 2.105 . . . . 0.0 109.73 177.532 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -58.86 -21.07 56.21 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -170.902 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -146.59 152.54 39.09 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.046 1.738 . . . . 0.0 110.606 173.86 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.56 -76.41 0.56 Allowed 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.782 1.233 . . . . 0.0 111.108 176.388 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.1 mt -127.87 -12.05 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -174.388 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 -79.86 -11.44 59.81 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -175.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.2 p -88.08 -49.32 7.11 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.781 1.232 . . . . 0.0 112.92 -176.843 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -66.79 -16.31 64.18 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -175.269 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.6 t -73.39 -26.17 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.567 1.547 . . . . 0.0 111.843 174.015 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.7 t -130.06 64.26 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.777 1.631 . . . . 0.0 109.4 -177.602 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.6 tp -136.39 148.84 48.02 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.129 1.372 . . . . 0.0 111.915 -174.075 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -112.53 53.41 0.74 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.385 1.874 . . . . 0.0 111.323 -172.123 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 44.63 77.52 0.45 Allowed Pre-proline 0 CA--C 1.554 1.109 0 C-N-CA 127.017 2.127 . . . . 0.0 114.691 171.732 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -75.02 80.0 2.54 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.562 2.841 . . . . 0.0 112.968 -173.361 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -131.25 -58.02 1.01 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.721 1.608 . . . . 0.0 112.868 174.877 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.4 t -136.86 78.93 40.58 Favored Pre-proline 0 N--CA 1.481 1.116 0 C-N-CA 124.487 1.115 . . . . 0.0 111.117 -174.94 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -74.0 168.03 25.77 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.036 2.49 . . . . 0.0 112.814 170.703 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.6 p -106.53 50.13 0.78 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.645 1.978 . . . . 0.0 113.63 -169.35 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.67 17.01 0.96 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 116.513 2.042 . . . . 0.0 116.513 -172.816 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -81.34 62.81 5.41 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.766 2.027 . . . . 0.0 112.239 -171.619 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.2 t -138.43 4.35 2.4 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -172.076 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 161.11 69.05 0.02 OUTLIER Glycine 0 N--CA 1.472 1.083 0 O-C-N 120.889 -1.132 . . . . 0.0 114.121 178.393 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -129.93 -90.82 0.46 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.222 1.009 . . . . 0.0 110.998 178.181 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -105.2 99.49 9.1 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.067 1.347 . . . . 0.0 110.348 -176.481 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.5 t -92.06 -69.79 0.72 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.312 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -161.8 -29.95 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.64 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -99.39 0.07 41.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.996 1.318 . . . . 0.0 112.311 177.748 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -106.39 -37.11 6.61 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.189 0.904 . . . . 0.0 112.87 175.603 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -65.15 -29.41 70.24 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.776 -1.202 . . . . 0.0 112.515 174.331 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -65.66 -6.38 11.16 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.829 1.252 . . . . 0.0 114.147 170.263 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.0 mp -104.89 -55.81 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 125.52 1.528 . . . . 0.0 110.116 167.422 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.9 t -65.05 -55.93 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 119.435 1.016 . . . . 0.0 111.613 -172.324 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.96 65.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -175.397 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -34.4 73.8 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.645 -0.659 . . . . 0.0 112.572 166.849 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.72 -37.95 70.57 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.25 0.932 . . . . 0.0 111.796 172.711 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -60.16 -31.16 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 120.491 -1.381 . . . . 0.0 110.899 173.053 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 t -74.28 -13.17 60.73 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 171.997 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -102.05 -43.98 5.6 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.529 -1.357 . . . . 0.0 112.959 -167.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.06 -11.7 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -169.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 135.47 -86.44 0.25 Allowed Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.767 1.175 . . . . 0.0 111.462 170.939 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -162.56 -44.74 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.599 1.56 . . . . 0.0 111.109 176.598 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -104.24 -13.44 16.18 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.516 1.526 . . . . 0.0 114.596 -168.591 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -85.99 -16.28 38.82 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.112 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -66.33 159.78 26.03 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.981 1.312 . . . . 0.0 113.815 179.12 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -104.23 117.97 35.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.225 1.01 . . . . 0.0 110.747 178.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.56 -24.4 66.62 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.519 1.127 . . . . 0.0 113.63 178.84 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.6 m -68.22 -40.72 81.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.041 0.936 . . . . 0.0 111.769 173.638 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -68.01 -29.19 68.13 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.353 -1.467 . . . . 0.0 113.007 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.64 -57.71 7.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.932 0.893 . . . . 0.0 111.345 165.616 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.0 p -60.44 -24.64 65.36 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.38 1.072 . . . . 0.0 113.657 -174.87 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -67.98 -24.51 65.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.496 1.918 . . . . 0.0 114.257 173.617 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 mtm-85 -112.65 -37.08 5.01 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.818 1.647 . . . . 0.0 113.411 -179.672 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -73.8 -17.83 61.03 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.108 0.963 . . . . 0.0 112.45 171.429 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 57.69 49.9 11.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.64 1.576 . . . . 0.0 111.626 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.0 pt -113.98 175.37 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 127.254 2.222 . . . . 0.0 110.952 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.4 m -71.96 137.57 47.41 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.726 1.61 . . . . 0.0 108.854 165.881 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.5 t -57.04 -40.13 70.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 O-C-N 121.782 -0.574 . . . . 0.0 111.139 -178.602 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.18 -26.95 63.19 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.335 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -68.23 -39.33 82.34 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.739 168.903 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.05 -49.09 73.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.461 1.028 . . . . 0.0 110.433 175.926 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -54.55 -41.42 69.76 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.492 1.517 . . . . 0.0 112.866 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -87.08 -33.32 19.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 177.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -61.91 -38.94 90.26 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.072 -1.017 . . . . 0.0 112.508 178.072 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.7 mt -46.86 -58.04 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.093 1.357 . . . . 0.0 110.358 173.581 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -72.89 -33.21 65.9 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.413 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -67.52 -33.31 74.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.202 0.91 . . . . 0.0 113.181 -178.704 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.6 m -91.25 -36.98 13.59 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 175.193 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -143.65 89.92 2.11 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.734 0.814 . . . . 0.0 112.411 -178.432 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.49 -0.78 51.85 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 115.07 1.508 . . . . 0.0 115.07 167.714 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 23.8 ptp -84.63 21.01 1.6 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -170.798 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.12 -57.57 3.17 Favored Glycine 0 N--CA 1.474 1.227 0 O-C-N 120.989 -1.07 . . . . 0.0 114.233 -170.126 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -140.37 53.08 1.64 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.522 1.529 . . . . 0.0 110.827 170.612 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.8 p 53.82 23.8 4.05 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 167.546 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 48.55 27.31 1.42 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.317 1.847 . . . . 0.0 114.388 -168.974 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.8 -10.33 24.97 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.738 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -70.72 10.72 0.46 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.197 2.199 . . . . 0.0 116.38 -169.302 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -87.1 -9.56 55.04 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.322 1.849 . . . . 0.0 114.817 -169.897 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.1 m -140.56 -44.09 0.4 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.778 1.631 . . . . 0.0 110.61 -165.599 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.0 pt -62.59 169.4 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 124.402 1.081 . . . . 0.0 111.697 169.585 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt 69.13 -19.99 0.17 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.574 1.949 . . . . 0.0 115.95 176.293 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 17.1 ptp -124.44 6.99 8.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.437 1.495 . . . . 0.0 113.79 -175.699 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -146.89 -30.51 0.35 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.27 1.428 . . . . 0.0 113.331 -167.588 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -124.0 160.69 27.07 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.148 1.779 . . . . 0.0 112.41 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -140.54 151.17 44.54 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.339 1.456 . . . . 0.0 111.969 -173.281 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -132.18 142.23 49.37 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.528 1.531 . . . . 0.0 111.754 -179.295 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.1 t -128.45 -48.15 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.714 1.205 . . . . 0.0 111.637 -179.296 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.9 m -120.5 17.38 12.11 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.293 1.437 . . . . 0.0 113.223 -177.822 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.5 t 62.47 152.95 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.273 2.229 . . . . 0.0 114.67 -166.065 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -149.81 128.0 12.04 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.23 1.412 . . . . 0.0 111.051 176.399 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 69.9 m -146.45 159.23 43.67 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.806 1.642 . . . . 0.0 111.072 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.4 34.08 0.31 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.532 1.533 . . . . 0.0 113.455 178.629 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 58.67 161.56 0.09 OUTLIER Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 129.026 2.93 . . . . 0.0 115.004 -171.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -64.61 108.93 1.13 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.746 2.297 . . . . 0.0 110.988 175.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -130.7 45.84 2.75 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.052 1.741 . . . . 0.0 110.422 -174.331 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 96.9 mt -118.79 150.85 49.22 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.177 1.791 . . . . 0.0 111.761 -174.375 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.057 3.172 . . . . 0.0 113.417 179.371 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 N-CA-C 112.054 -0.418 . . . . 0.0 112.054 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 49.5 m -86.3 138.87 31.5 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.47 1.108 . . . . 0.0 112.139 179.912 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -149.31 114.62 5.51 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.533 1.133 . . . . 0.0 110.386 178.791 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 86.5 mmm -135.4 93.22 2.94 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.253 1.421 . . . . 0.0 109.942 -178.103 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -144.92 -73.59 0.25 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.534 1.134 . . . . 0.0 112.315 -178.598 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 54.97 20.92 3.4 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 179.107 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? -144.29 -12.1 0.62 Allowed 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 177.05 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -111.42 -8.33 14.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.959 1.304 . . . . 0.0 114.149 -178.822 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -108.71 -10.61 15.15 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -173.772 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.1 mp -75.32 138.74 42.0 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.327 0.651 . . . . 0.0 111.362 -171.583 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -140.5 -3.45 1.32 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.498 1.119 . . . . 0.0 113.918 -179.052 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -98.33 89.04 4.32 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.186 1.395 . . . . 0.0 110.62 177.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.2 mp -132.05 124.5 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.306 1.442 . . . . 0.0 109.024 177.235 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.2 mt -136.09 49.67 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 125.187 1.395 . . . . 0.0 110.061 -176.565 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -136.33 155.05 50.61 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.456 1.502 . . . . 0.0 111.67 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.89 29.07 2.1 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.694 1.198 . . . . 0.0 114.189 -175.403 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.2 pt -131.52 123.41 52.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.894 1.678 . . . . 0.0 110.79 -179.153 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -125.17 -97.4 0.43 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.639 1.576 . . . . 0.0 110.477 179.785 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -150.71 63.68 0.93 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 126.139 1.776 . . . . 0.0 110.502 179.314 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -81.7 53.32 2.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.934 1.294 . . . . 0.0 113.436 -170.304 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -103.31 5.11 37.17 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -174.194 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mp -106.02 -0.68 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 125.985 1.714 . . . . 0.0 112.894 -171.457 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -96.9 7.05 47.48 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -174.476 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.2 t -137.07 -23.0 1.16 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -174.095 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -89.6 -13.21 37.67 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.595 1.958 . . . . 0.0 115.249 -173.765 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.6 t -91.98 -27.97 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.96 1.304 . . . . 0.0 112.23 -174.585 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.23 47.05 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 125.013 1.325 . . . . 0.0 111.854 -168.858 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.8 mt -135.83 129.32 32.24 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.649 1.579 . . . . 0.0 111.763 178.119 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -136.23 16.05 3.23 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 126.131 1.773 . . . . 0.0 114.6 -174.106 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 t30 50.08 70.73 1.87 Allowed Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 126.527 1.931 . . . . 0.0 112.725 -176.092 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -77.94 74.5 5.23 Favored 'Trans proline' 0 CA--C 1.546 1.083 0 C-N-CA 124.302 3.335 . . . . 0.0 113.342 -168.406 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 55.9 mtm-85 -134.46 -58.96 0.82 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.61 1.564 . . . . 0.0 113.094 173.089 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.1 t -141.65 107.53 5.98 Favored Pre-proline 0 N--CA 1.476 0.863 0 C-N-CA 125.109 1.364 . . . . 0.0 109.578 -178.811 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -73.39 162.08 41.07 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.361 2.707 . . . . 0.0 112.008 169.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 t -137.1 101.81 4.66 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.942 1.297 . . . . 0.0 109.786 -174.667 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -131.42 18.48 4.83 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 -168.19 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.5 ttpt -93.96 69.26 3.88 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.791 1.636 . . . . 0.0 111.88 -169.118 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -144.31 24.35 1.6 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.917 1.287 . . . . 0.0 113.616 -168.323 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.24 10.56 27.61 Favored Glycine 0 CA--C 1.541 1.701 0 O-C-N 120.315 -1.49 . . . . 0.0 115.838 -177.056 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -86.54 -0.48 56.19 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -168.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.7 mp -122.59 124.9 44.56 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 125.164 1.386 . . . . 0.0 110.46 179.783 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -104.74 -75.07 0.63 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.894 1.678 . . . . 0.0 111.648 -178.89 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -158.83 -40.65 0.06 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.61 -31.5 71.57 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 122.178 -0.326 . . . . 0.0 110.897 172.348 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -71.01 -44.81 65.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.644 0.778 . . . . 0.0 112.004 -171.84 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt -71.41 -22.54 61.85 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.54 -1.35 . . . . 0.0 112.977 175.625 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -70.87 1.48 5.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.997 1.319 . . . . 0.0 113.973 164.814 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 mt -115.31 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.136 1.774 . . . . 0.0 110.319 168.652 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.26 -62.3 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.047 1.294 . . . . 0.0 112.069 -178.613 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.36 -33.19 74.7 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.646 -0.659 . . . . 0.0 110.991 -177.183 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.29 -23.3 65.59 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 169.608 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.67 -40.73 17.06 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.461 1.028 . . . . 0.0 111.216 172.738 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.61 -35.44 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.995 -1.065 . . . . 0.0 111.499 176.71 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.8 p -76.8 -5.21 47.32 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 174.937 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -98.76 -54.17 3.08 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.331 1.423 . . . . 0.0 112.055 177.091 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -115.58 -16.36 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -166.109 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.65 -78.88 0.36 Allowed Glycine 0 N--CA 1.467 0.717 0 C-N-CA 125.494 1.521 . . . . 0.0 111.579 167.645 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -165.94 -45.24 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.842 1.257 . . . . 0.0 112.141 174.148 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -97.33 -14.9 21.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.208 1.803 . . . . 0.0 114.381 -172.796 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -87.68 -15.62 36.65 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -171.683 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -67.69 165.35 17.37 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.914 1.285 . . . . 0.0 112.115 165.023 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.6 p30 -119.35 169.46 9.98 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.466 1.127 . . . . 0.0 112.043 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.2 -26.5 39.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.667 1.187 . . . . 0.0 112.819 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -63.71 -51.58 64.38 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.953 1.301 . . . . 0.0 111.275 -179.161 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -62.89 -39.03 93.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.528 0.731 . . . . 0.0 111.587 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.33 -46.03 90.52 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.294 0.637 . . . . 0.0 111.608 174.289 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.4 p -62.04 -25.81 67.89 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.984 -1.073 . . . . 0.0 113.685 177.998 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -84.27 -39.05 19.72 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.487 1.515 . . . . 0.0 112.021 -177.187 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -91.16 -38.68 12.58 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.259 1.024 . . . . 0.0 113.348 -179.762 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.01 -19.88 42.99 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.561 1.144 . . . . 0.0 113.072 177.976 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 61.76 69.33 0.65 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.876 1.67 . . . . 0.0 112.143 -177.49 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.5 pt -137.42 168.39 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 126.734 2.013 . . . . 0.0 111.467 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.7 m -60.81 139.21 58.01 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.413 1.485 . . . . 0.0 110.147 162.496 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -61.12 -35.29 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.28 -0.887 . . . . 0.0 111.511 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.79 -30.01 66.36 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.095 -1.003 . . . . 0.0 113.377 177.551 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.47 -40.05 94.96 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.82 167.971 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.07 -48.42 73.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.194 0.906 . . . . 0.0 110.962 177.254 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -56.1 -40.84 74.29 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.797 1.239 . . . . 0.0 112.476 179.474 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -88.4 -33.68 17.81 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.19 -38.31 90.69 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.237 1.015 . . . . 0.0 112.359 177.48 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.5 mt -48.92 -52.54 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.216 1.006 . . . . 0.0 110.651 175.464 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -80.85 -32.33 35.09 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -75.6 -26.73 58.11 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.882 1.219 . . . . 0.0 113.179 -179.024 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.5 t -88.54 -40.92 13.04 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.444 1.098 . . . . 0.0 112.626 174.656 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -149.64 75.65 1.27 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.296 1.038 . . . . 0.0 113.054 -177.198 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -62.3 -54.08 45.75 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.205 -0.935 . . . . 0.0 113.317 -179.367 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 25.2 ptm -161.74 12.31 0.08 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.704 1.602 . . . . 0.0 113.496 -176.571 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.16 30.88 7.96 Favored Glycine 0 N--CA 1.471 1.003 0 O-C-N 120.919 -1.113 . . . . 0.0 114.436 -164.905 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 26.0 mmm-85 47.95 49.52 16.92 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.634 1.574 . . . . 0.0 112.025 -175.683 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 53.21 18.58 1.26 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.128 1.771 . . . . 0.0 115.09 -176.498 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.8 m120 48.45 32.36 3.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.887 1.675 . . . . 0.0 113.436 -167.327 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.29 -5.38 19.17 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.254 1.422 . . . . 0.0 114.478 -179.464 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -75.45 13.82 0.7 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.512 1.925 . . . . 0.0 115.526 -168.573 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -91.47 11.85 22.65 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.685 1.994 . . . . 0.0 113.752 -163.897 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.6 m -150.94 -47.84 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.658 2.783 . . . . 0.0 108.604 -169.858 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -73.99 156.08 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.224 1.01 . . . . 0.0 109.454 179.371 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.47 -7.11 0.57 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 127.411 2.284 . . . . 0.0 116.438 -178.683 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 37.2 mtm -96.91 -50.59 4.58 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.946 1.248 . . . . 0.0 113.678 -174.705 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -91.41 -7.67 50.05 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -176.556 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -83.63 6.68 19.93 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.221 1.408 . . . . 0.0 114.247 -168.699 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -122.13 129.72 52.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.283 1.833 . . . . 0.0 111.46 179.032 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -152.29 156.9 40.57 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.951 1.3 . . . . 0.0 111.119 174.361 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.5 t -139.5 -39.28 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 125.206 1.402 . . . . 0.0 111.875 -176.88 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 33.2 m -127.13 22.0 6.69 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.15 1.38 . . . . 0.0 113.191 -173.507 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.9 t 57.86 58.87 3.42 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.878 1.671 . . . . 0.0 112.811 -174.528 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.53 164.47 25.79 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.029 1.332 . . . . 0.0 113.708 -179.543 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 83.7 p -110.49 170.41 8.1 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.566 1.547 . . . . 0.0 112.798 177.784 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.18 21.09 0.61 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.158 1.383 . . . . 0.0 114.186 178.231 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 50.93 71.55 1.5 Allowed Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 127.042 2.137 . . . . 0.0 113.105 -179.7 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.77 87.2 0.69 Allowed 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.531 3.488 . . . . 0.0 112.372 -174.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -136.77 33.71 2.67 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.128 1.771 . . . . 0.0 111.883 -179.63 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 93.2 mt -98.21 146.18 31.1 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.507 1.523 . . . . 0.0 111.866 -179.08 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo . . . . . 0 C--O 1.253 1.236 0 C-N-CA 124.05 3.167 . . . . 0.0 113.311 178.792 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.592 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 53.5 m -133.84 161.7 34.03 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.624 1.57 . . . . 0.0 112.066 -177.319 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -112.36 140.74 46.83 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.084 1.353 . . . . 0.0 111.51 177.258 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 24.3 ttt -137.04 63.31 1.57 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.278 1.431 . . . . 0.0 111.937 -167.716 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -147.46 92.47 2.1 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.701 1.2 . . . . 0.0 110.717 173.239 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 17.9 m -138.93 7.78 2.49 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -165.392 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.2 mtm -138.6 -7.66 1.47 Allowed 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 -168.114 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -132.56 12.96 4.51 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.242 1.417 . . . . 0.0 112.164 -178.073 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -145.03 12.09 1.39 Allowed 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -160.048 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.2 mp -130.69 64.26 1.56 Allowed 'General case' 0 N--CA 1.476 0.852 0 O-C-N 120.589 -1.32 . . . . 0.0 111.201 -174.721 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -133.31 11.66 4.17 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.976 1.31 . . . . 0.0 113.855 -171.187 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -131.53 19.2 4.75 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.476 1.51 . . . . 0.0 114.211 -169.128 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 56.6 mt -87.34 68.93 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.441 1.496 . . . . 0.0 110.111 -167.858 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 20.9 tt -152.46 72.58 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.956 1.303 . . . . 0.0 112.212 -173.642 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -128.57 32.18 4.87 Favored 'General case' 0 CA--C 1.552 1.055 0 O-C-N 120.728 -1.232 . . . . 0.0 113.363 -174.183 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -143.35 -63.55 0.4 Allowed 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.827 -1.17 . . . . 0.0 113.143 -179.389 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 10.4 pt -125.81 111.49 27.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.969 1.707 . . . . 0.0 109.729 -176.665 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -154.15 166.82 31.88 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.926 1.691 . . . . 0.0 112.102 -172.665 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -79.75 39.54 0.42 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.673 1.989 . . . . 0.0 113.613 -171.62 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -88.62 117.88 27.89 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.929 1.291 . . . . 0.0 111.086 175.874 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.87 -73.31 0.29 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.67 1.188 . . . . 0.0 111.658 168.115 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 59.2 mt -123.42 -8.23 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.894 1.278 . . . . 0.0 113.771 -173.732 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -68.04 -23.27 64.96 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.311 -0.868 . . . . 0.0 112.764 -173.896 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.4 m -82.65 -17.97 42.72 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.076 1.35 . . . . 0.0 114.354 -173.34 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -109.98 -14.07 14.31 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 179.274 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 74.2 t -84.37 -38.54 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.387 1.075 . . . . 0.0 111.178 177.02 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.2 t -101.76 77.49 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.752 1.221 . . . . 0.0 109.797 -177.949 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.1 mt -131.82 145.02 51.33 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.806 1.642 . . . . 0.0 111.544 178.471 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -129.13 37.7 4.01 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 126.028 1.731 . . . . 0.0 112.595 -178.534 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 t30 49.94 66.04 6.12 Favored Pre-proline 0 CA--C 1.557 1.239 0 C-N-CA 126.788 2.035 . . . . 0.0 113.674 -179.824 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -77.05 67.27 7.62 Favored 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 124.493 3.462 . . . . 0.0 112.497 -176.394 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -133.84 -58.84 0.86 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.273 1.829 . . . . 0.0 112.576 -178.319 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 44.4 t -137.63 97.75 10.14 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 125.145 1.378 . . . . 0.0 109.902 -175.614 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -76.99 170.39 19.88 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.297 2.664 . . . . 0.0 113.045 173.656 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.4 p -128.39 71.25 1.38 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.43 1.492 . . . . 0.0 112.343 -163.123 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -107.03 22.62 15.7 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -170.329 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.73 26.25 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 128.193 2.597 . . . . 0.0 115.452 -178.691 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.7 t -146.39 11.66 1.16 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.138 1.375 . . . . 0.0 114.161 -163.548 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.7 74.52 0.07 OUTLIER Glycine 0 CA--C 1.531 1.055 0 O-C-N 120.43 -1.419 . . . . 0.0 112.469 -177.272 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -121.08 21.46 11.27 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.011 1.324 . . . . 0.0 113.776 -165.214 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp 58.99 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.395 2.678 . . . . 0.0 113.894 -176.281 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -82.73 -71.37 0.5 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.996 0.918 . . . . 0.0 112.726 -175.536 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -163.57 -35.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.101 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -29.22 47.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.74 0.416 . . . . 0.0 111.095 170.906 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -77.62 -42.64 34.21 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.569 1.548 . . . . 0.0 112.045 -168.576 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -68.73 -26.14 65.11 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.228 -0.92 . . . . 0.0 113.035 173.752 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -68.9 -1.09 6.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.164 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 mt -113.86 -45.23 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.414 1.486 . . . . 0.0 110.209 172.078 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 36.4 t -73.55 -64.16 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 CA-C-N 119.459 1.027 . . . . 0.0 112.01 179.07 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.01 -27.42 65.66 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.786 -0.571 . . . . 0.0 112.377 -174.819 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.67 -42.36 78.89 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 165.699 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -36.45 81.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.905 0.882 . . . . 0.0 111.736 175.557 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.4 mm -62.84 -22.11 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 120.861 -1.149 . . . . 0.0 111.429 175.023 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 t -83.79 -11.16 57.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 171.905 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -96.93 -60.03 1.68 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.522 -1.361 . . . . 0.0 112.099 -175.835 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -113.46 -17.47 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 N-CA-C 114.922 1.452 . . . . 0.0 114.922 -164.535 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.47 -83.87 0.26 Allowed Glycine 0 N--CA 1.465 0.632 0 C-N-CA 125.349 1.452 . . . . 0.0 111.171 167.615 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -161.3 -46.7 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.58 1.152 . . . . 0.0 112.333 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -96.97 -20.31 18.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.189 1.796 . . . . 0.0 114.472 -174.765 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -84.65 -11.26 56.29 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -167.627 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.31 163.03 23.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.178 1.791 . . . . 0.0 114.417 176.4 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -87.75 -172.41 3.85 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.77 1.628 . . . . 0.0 109.991 174.572 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -120.82 -19.22 7.4 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.038 1.335 . . . . 0.0 112.964 167.379 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.9 m -72.26 -53.41 12.57 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.401 1.08 . . . . 0.0 112.286 -173.415 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.2 -25.03 65.02 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 120.75 -1.219 . . . . 0.0 113.673 179.764 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.28 -58.89 4.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.517 0.727 . . . . 0.0 111.101 166.566 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.5 p -61.1 -25.62 67.09 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -177.121 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -69.06 -41.16 77.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.567 1.547 . . . . 0.0 113.082 171.569 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -89.73 -37.95 14.19 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.272 1.429 . . . . 0.0 112.879 -174.967 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -20.33 57.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.103 1.361 . . . . 0.0 113.172 171.028 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.21 58.91 2.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.833 1.253 . . . . 0.0 111.398 -177.717 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.0 pt -123.25 174.47 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 127.069 2.147 . . . . 0.0 110.185 174.194 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 51.7 m -70.36 141.29 52.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.643 1.577 . . . . 0.0 109.515 166.783 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.3 t -58.58 -39.39 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 O-C-N 121.426 -0.796 . . . . 0.0 111.057 179.442 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -70.52 -28.5 64.99 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.359 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -66.34 -39.52 89.28 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.125 -0.941 . . . . 0.0 110.786 168.796 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.65 72.22 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.251 0.932 . . . . 0.0 110.544 176.208 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -54.87 -37.73 66.63 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.088 1.355 . . . . 0.0 113.044 -179.143 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -86.51 -41.23 14.52 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 118.792 0.724 . . . . 0.0 112.732 174.695 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -61.33 -34.78 75.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.067 -1.02 . . . . 0.0 113.066 -177.787 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.0 mt -46.66 -62.75 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.134 1.374 . . . . 0.0 110.027 171.38 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -76.32 -19.11 58.56 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -179.417 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -77.02 -30.33 55.77 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.832 0.742 . . . . 0.0 112.502 177.222 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -102.88 -46.35 4.71 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.146 1.378 . . . . 0.0 113.61 -177.737 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.7 91.66 3.59 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.956 1.302 . . . . 0.0 111.998 -178.416 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 15.3 ptt85 -134.37 24.68 3.8 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.692 1.597 . . . . 0.0 115.026 176.64 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.1 mtt -76.43 -38.75 55.05 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.823 0.849 . . . . 0.0 112.809 -176.131 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.31 98.53 0.7 Allowed Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.456 1.503 . . . . 0.0 110.988 -177.403 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 48.8 33.64 4.56 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 125.451 1.5 . . . . 0.0 112.83 -173.308 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 50.78 31.68 6.26 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 126.618 1.967 . . . . 0.0 113.174 -175.381 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.3 m120 53.9 26.39 6.19 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.252 1.821 . . . . 0.0 115.049 -174.568 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -8.61 40.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.495 1.118 . . . . 0.0 113.917 -178.514 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 p90 -70.37 7.31 1.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.931 2.092 . . . . 0.0 116.619 -168.635 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 -4.62 59.21 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.448 1.499 . . . . 0.0 114.796 -169.8 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.5 m -141.88 -46.53 0.36 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.02 1.728 . . . . 0.0 109.93 -167.147 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.6 169.8 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 123.637 0.775 . . . . 0.0 111.329 173.69 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 69.06 -14.29 0.31 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.051 2.14 . . . . 0.0 115.5 -174.907 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 13.43 2.2 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 178.339 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -146.54 38.14 1.02 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.226 1.01 . . . . 0.0 112.904 -173.334 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -145.02 153.51 41.56 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.792 1.237 . . . . 0.0 112.975 -168.05 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -94.21 171.3 8.92 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.514 1.526 . . . . 0.0 112.202 -178.597 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -71.59 141.35 50.03 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.902 -1.124 . . . . 0.0 112.784 176.609 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.1 t -131.21 -48.18 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 125.057 1.343 . . . . 0.0 111.33 176.194 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 23.4 m -119.25 15.63 13.11 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.052 1.341 . . . . 0.0 113.641 -176.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.2 t 53.99 82.69 0.08 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 126.849 2.06 . . . . 0.0 113.738 -176.576 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -140.72 106.71 5.18 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.651 1.18 . . . . 0.0 111.442 -179.657 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.9 m -142.31 116.63 9.56 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.23 1.412 . . . . 0.0 111.138 -178.568 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 53.61 28.48 7.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.527 1.531 . . . . 0.0 114.796 -178.285 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -118.98 147.84 43.39 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 126.676 1.99 . . . . 0.0 111.969 -172.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.27 103.57 1.64 Allowed 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.331 2.687 . . . . 0.0 110.731 175.978 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -141.64 30.29 1.7 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.426 1.09 . . . . 0.0 112.731 -176.447 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 96.5 mt -126.88 87.63 56.18 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.164 1.785 . . . . 0.0 110.346 -175.301 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 C--O 1.252 1.217 0 C-N-CA 123.876 3.051 . . . . 0.0 113.233 179.547 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.61 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 61.6 p -127.35 149.0 50.25 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.528 1.531 . . . . 0.0 112.129 178.006 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -150.7 126.45 10.31 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.758 1.223 . . . . 0.0 110.502 178.874 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 64.5 mtt -138.88 106.62 5.63 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.676 1.191 . . . . 0.0 110.273 -178.679 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -119.9 19.39 12.4 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.273 1.429 . . . . 0.0 114.473 -175.117 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 67.0 m -119.07 17.48 13.25 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.484 1.514 . . . . 0.0 113.822 -169.639 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -150.6 -13.0 0.24 Allowed 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 116.309 1.966 . . . . 0.0 116.309 -176.606 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -133.38 13.25 4.17 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.683 1.593 . . . . 0.0 112.611 -175.697 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -139.4 18.12 2.56 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.398 1.879 . . . . 0.0 112.234 -171.884 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 68.4 mt -118.22 173.54 6.74 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.772 1.629 . . . . 0.0 111.038 -174.025 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -131.68 12.8 4.9 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -177.788 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -97.61 4.25 50.23 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -176.118 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.412 HD12 ' H ' ' A' ' 7' ' ' ILE . 2.9 mp -76.31 -40.26 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.212 1.005 . . . . 0.0 112.463 -167.928 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 65.5 mt -134.35 142.07 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.808 1.643 . . . . 0.0 109.961 -174.272 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -120.66 157.64 29.14 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.118 1.767 . . . . 0.0 111.629 177.515 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -140.71 -74.15 0.34 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.542 1.137 . . . . 0.0 111.865 -172.453 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.4 tt -140.0 118.24 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 126.05 1.74 . . . . 0.0 109.461 -179.217 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -152.45 35.87 0.51 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.259 1.424 . . . . 0.0 112.588 -169.862 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 52.72 35.55 18.78 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 126.353 1.861 . . . . 0.0 114.392 177.153 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 48.8 76.13 0.13 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.908 2.083 . . . . 0.0 114.348 -175.591 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.1 -70.41 0.44 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -175.702 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 50.9 mt -131.54 -14.15 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 125.451 1.501 . . . . 0.0 113.304 -175.856 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -71.54 -20.12 62.08 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -166.024 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.2 m -100.46 -40.3 7.53 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.888 0.875 . . . . 0.0 112.774 -176.468 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -83.14 -12.12 57.28 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 -175.175 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -101.72 -30.78 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.777 1.231 . . . . 0.0 111.795 170.441 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.0 t -131.36 88.67 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.749 1.22 . . . . 0.0 110.431 -177.367 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.6 tp -117.21 136.93 52.7 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.448 1.099 . . . . 0.0 111.258 173.066 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -127.29 28.34 5.74 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.873 1.669 . . . . 0.0 112.548 -175.811 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.2 t30 45.82 60.84 13.42 Favored Pre-proline 0 CA--C 1.557 1.215 0 C-N-CA 127.076 2.15 . . . . 0.0 113.324 -173.285 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -79.92 67.72 8.53 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 124.14 3.227 . . . . 0.0 112.611 -171.088 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -117.71 -67.62 0.98 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.823 1.649 . . . . 0.0 112.196 -177.408 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.0 t -145.43 108.68 4.5 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.644 1.578 . . . . 0.0 109.498 -175.468 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -80.54 170.73 15.52 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.42 2.747 . . . . 0.0 113.313 175.115 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.4 p -132.79 77.8 1.76 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.863 1.665 . . . . 0.0 111.645 -163.561 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -119.59 19.27 12.64 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -171.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.6 ttpt -87.81 77.98 8.46 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.636 1.574 . . . . 0.0 111.234 -176.919 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.2 t -142.59 48.78 1.52 Allowed 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 123.059 1.409 . . . . 0.0 112.576 -171.073 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.74 66.42 1.41 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.68 1.134 . . . . 0.0 112.975 178.413 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -89.11 14.19 11.34 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.4 1.48 . . . . 0.0 114.078 -173.059 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp -129.12 136.8 50.69 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 126.374 1.87 . . . . 0.0 110.534 178.941 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.6 p -126.46 -69.64 0.76 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.667 1.587 . . . . 0.0 112.378 174.786 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.89 -34.31 0.05 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -167.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -76.83 -13.98 59.95 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.568 0.747 . . . . 0.0 111.278 172.347 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 mp0 -86.87 -43.65 12.29 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.097 0.862 . . . . 0.0 112.719 -177.304 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.32 -32.9 74.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.153 -0.967 . . . . 0.0 112.367 178.514 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -64.5 -2.79 2.52 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 115.548 1.685 . . . . 0.0 115.548 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.8 mt -112.12 -17.4 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.734 1.613 . . . . 0.0 112.276 174.443 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 17.9 t -127.68 -53.14 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.187 0.903 . . . . 0.0 113.373 -172.962 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.82 -37.89 88.54 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.778 1.172 . . . . 0.0 110.845 171.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.95 -28.3 69.43 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.992 0.917 . . . . 0.0 113.054 170.749 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -37.84 59.24 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.307 1.043 . . . . 0.0 111.59 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.5 -33.78 55.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.937 -1.102 . . . . 0.0 110.773 170.327 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -72.57 -10.31 59.64 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 169.67 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -107.53 -42.72 4.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.499 1.499 . . . . 0.0 112.987 -172.874 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.0 m -127.99 -13.19 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -173.082 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -83.35 0.3 Allowed Glycine 0 N--CA 1.469 0.89 0 C-N-CA 124.931 1.253 . . . . 0.0 112.223 169.092 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.8 tt -167.85 -44.5 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.123 1.769 . . . . 0.0 111.01 -177.504 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -107.44 -10.57 15.71 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.174 1.79 . . . . 0.0 114.913 -168.987 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -89.2 -20.34 24.31 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -176.39 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.15 162.82 23.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.638 1.175 . . . . 0.0 112.116 166.48 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -120.73 174.24 6.71 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.526 1.155 . . . . 0.0 112.007 174.805 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.1 -23.95 35.43 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.906 1.282 . . . . 0.0 112.995 179.355 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.7 m -63.36 -51.4 66.09 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.252 1.421 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -64.33 -39.07 93.16 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.41 -0.806 . . . . 0.0 112.183 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.33 -51.03 71.5 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 168.537 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.5 p -60.14 -24.86 65.03 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.686 -1.259 . . . . 0.0 113.831 -178.529 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -87.15 -47.93 8.48 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.177 1.791 . . . . 0.0 111.922 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -90.24 -29.53 18.13 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.368 1.067 . . . . 0.0 113.39 -174.855 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.2 tp -93.99 -14.57 25.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.759 1.624 . . . . 0.0 112.785 178.623 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.16 66.59 0.94 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.307 1.843 . . . . 0.0 112.644 175.569 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 pt -142.94 167.56 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 127.263 2.225 . . . . 0.0 111.078 -179.059 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.407 HG22 ' H ' ' A' ' 69' ' ' ASP . 7.4 m -53.93 139.55 33.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.581 1.552 . . . . 0.0 110.813 164.487 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 t -58.31 -38.54 69.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 121.602 -0.686 . . . . 0.0 111.149 175.326 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.407 ' H ' HG22 ' A' ' 67' ' ' THR . 20.0 m-20 -72.9 -28.67 62.62 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.132 -0.98 . . . . 0.0 113.356 -179.978 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -66.57 -37.43 84.92 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.498 -0.763 . . . . 0.0 110.937 168.139 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.12 -47.49 73.96 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.843 0.747 . . . . 0.0 110.555 174.954 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -57.28 -38.85 74.57 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.24 1.016 . . . . 0.0 112.738 -179.544 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -89.6 -31.64 17.48 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -63.65 -38.04 89.61 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 120.585 -1.322 . . . . 0.0 112.138 176.492 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.9 mt -49.66 -56.67 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.143 0.977 . . . . 0.0 110.545 174.648 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -70.93 -35.76 72.37 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 179.106 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -66.88 -31.54 72.21 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.348 0.976 . . . . 0.0 112.965 178.91 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -76.9 -40.29 47.91 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.287 1.035 . . . . 0.0 112.697 175.959 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -147.13 87.24 1.66 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.903 1.281 . . . . 0.0 111.592 -178.897 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -59.4 -42.27 91.38 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.223 1.409 . . . . 0.0 112.871 178.531 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.6 mtt -125.04 -36.13 2.58 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.744 1.618 . . . . 0.0 112.755 178.587 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 133.14 73.25 0.09 OUTLIER Glycine 0 N--CA 1.474 1.181 0 C-N-CA 123.423 0.535 . . . . 0.0 112.445 177.922 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 58.34 15.76 3.64 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -177.883 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 89.5 m -73.05 -10.15 59.49 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.892 0.877 . . . . 0.0 112.523 177.288 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.89 25.14 15.11 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.922 2.089 . . . . 0.0 113.426 165.16 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -87.96 -10.05 51.68 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.414 1.485 . . . . 0.0 113.449 -173.942 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -76.05 15.47 0.55 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.679 2.392 . . . . 0.0 114.59 -176.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 32.4 pttt -83.34 -6.71 59.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.22 2.608 . . . . 0.0 114.191 -171.14 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 44.3 m -143.16 -54.54 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 126.586 1.955 . . . . 0.0 109.806 -172.486 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.5 pt -71.98 164.74 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.038 0.935 . . . . 0.0 111.91 177.81 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 -4.41 0.48 Allowed 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -178.617 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 44.3 mtm -97.83 -49.49 4.79 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.764 1.166 . . . . 0.0 113.627 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -107.26 -7.29 16.8 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -175.408 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -90.91 128.05 36.62 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.127 1.371 . . . . 0.0 111.568 -174.1 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -143.52 125.9 15.71 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.823 1.249 . . . . 0.0 110.817 174.224 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -145.74 147.93 32.44 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.145 1.778 . . . . 0.0 110.506 175.616 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 45.4 t -130.62 -45.01 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 124.189 0.996 . . . . 0.0 112.057 -179.33 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.0 p -119.83 7.61 11.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.341 1.456 . . . . 0.0 114.073 -176.166 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 t -137.12 24.24 3.01 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -168.733 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -102.61 133.74 47.11 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.642 1.177 . . . . 0.0 111.793 175.547 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.0 t -155.28 173.5 16.54 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.99 1.716 . . . . 0.0 109.697 176.358 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.73 -25.61 68.27 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.451 -0.78 . . . . 0.0 112.645 164.587 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.83 81.64 6.3 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.655 1.982 . . . . 0.0 112.961 175.527 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -79.83 50.11 3.41 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 124.576 3.517 . . . . 0.0 112.752 -176.76 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -117.88 65.42 0.75 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.467 1.907 . . . . 0.0 111.173 -169.064 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.5 tp -133.78 100.58 13.32 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.975 1.31 . . . . 0.0 110.677 -178.807 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo . . . . . 0 C--O 1.253 1.235 0 C-N-CA 123.789 2.992 . . . . 0.0 113.328 -179.407 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 63.1 m -127.57 153.05 46.85 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.384 1.474 . . . . 0.0 111.81 179.682 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -149.12 139.18 22.12 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.505 1.122 . . . . 0.0 111.651 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 66.3 mtt -136.4 95.31 3.15 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.088 1.355 . . . . 0.0 110.589 178.952 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -156.05 105.77 2.37 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.188 1.395 . . . . 0.0 110.235 175.035 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.5 t -116.41 -10.66 11.28 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 179.782 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 mmt -128.56 -7.94 5.15 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -169.381 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -113.68 6.44 16.88 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.068 1.747 . . . . 0.0 111.715 172.626 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.59 44.82 0.94 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.106 1.362 . . . . 0.0 111.94 -161.981 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 mp -132.24 111.03 11.04 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.589 1.556 . . . . 0.0 110.049 177.027 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -148.98 14.9 0.92 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.684 1.193 . . . . 0.0 113.157 -176.083 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -86.64 6.99 28.35 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.666 1.587 . . . . 0.0 114.388 -176.706 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -83.94 132.55 31.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 125.285 1.434 . . . . 0.0 111.458 -169.677 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.3 mp -89.73 -41.7 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.674 1.19 . . . . 0.0 111.412 179.425 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -138.92 134.7 33.56 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.505 1.522 . . . . 0.0 110.618 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -134.14 -62.59 0.75 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.68 0.792 . . . . 0.0 112.733 -178.123 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 39.1 pt -134.03 15.11 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.831 1.653 . . . . 0.0 113.387 -176.748 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -140.59 160.05 40.87 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.344 1.458 . . . . 0.0 112.482 -166.982 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -89.33 18.48 5.16 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.908 1.683 . . . . 0.0 113.838 176.669 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 58.87 122.91 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 127.78 2.432 . . . . 0.0 114.574 -166.72 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.74 -84.8 0.56 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.957 0.903 . . . . 0.0 112.142 175.435 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.9 mt -121.53 -12.93 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -168.928 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -74.74 -15.91 60.75 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -174.425 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 t -92.13 -53.74 4.12 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.6 1.16 . . . . 0.0 112.104 -174.673 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -66.9 -15.95 63.99 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -176.481 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.7 p -95.69 -8.55 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.848 1.659 . . . . 0.0 112.968 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.5 t -131.24 73.85 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.82 1.648 . . . . 0.0 109.738 178.657 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.4 mt -121.66 121.24 36.92 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.305 1.442 . . . . 0.0 111.598 -178.443 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -139.24 54.48 1.71 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.611 1.964 . . . . 0.0 111.544 178.151 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 t30 47.49 72.28 1.32 Allowed Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 126.999 2.12 . . . . 0.0 113.469 -177.048 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.74 74.97 4.65 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 124.109 3.206 . . . . 0.0 112.393 -174.346 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -121.04 -56.31 1.93 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.304 1.442 . . . . 0.0 113.152 179.058 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.1 t -137.29 65.51 50.04 Favored Pre-proline 0 N--CA 1.483 1.213 0 C-N-CA 124.283 1.033 . . . . 0.0 111.703 -177.969 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.03 156.59 47.38 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.429 2.086 . . . . 0.0 112.796 174.151 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.6 p -78.19 59.82 2.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.685 2.394 . . . . 0.0 113.522 -176.059 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -79.65 27.83 0.28 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.344 1.857 . . . . 0.0 115.834 -171.867 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -85.65 57.81 4.68 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 127.664 2.386 . . . . 0.0 112.481 -171.845 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.5 t -148.68 16.22 0.99 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -163.549 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -163.77 -69.72 0.02 OUTLIER Glycine 0 N--CA 1.474 1.183 0 O-C-N 120.346 -1.471 . . . . 0.0 113.498 178.948 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 62.18 18.48 10.13 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 115.864 1.802 . . . . 0.0 115.864 175.251 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp -136.11 129.78 32.35 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.036 1.334 . . . . 0.0 110.589 168.171 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.6 m -116.7 -70.21 0.81 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.308 1.843 . . . . 0.0 112.68 -175.182 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -161.82 -41.21 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -171.682 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.1 -27.6 61.8 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.627 . . . . 0.0 110.866 174.198 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -72.91 -33.93 66.29 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.872 1.269 . . . . 0.0 110.803 -176.087 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -70.21 -34.5 72.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.879 0.871 . . . . 0.0 112.296 170.509 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -65.46 -3.73 4.77 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 171.027 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 mt -107.85 -53.89 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.772 1.629 . . . . 0.0 110.124 167.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.21 -62.85 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 124.194 0.998 . . . . 0.0 112.148 -174.431 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.93 66.88 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.593 0.757 . . . . 0.0 111.903 -177.113 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.12 -44.8 83.65 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.792 0.437 . . . . 0.0 111.945 164.738 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.03 -38.11 89.87 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.343 1.057 . . . . 0.0 112.47 174.806 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -62.6 -19.4 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.941 0.897 . . . . 0.0 111.632 176.182 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -88.18 -13.07 42.08 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.98 1.312 . . . . 0.0 114.26 172.305 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -96.82 -55.57 2.84 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.544 -1.348 . . . . 0.0 112.207 -175.14 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.9 m -118.64 -18.11 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -167.551 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.23 -85.79 0.32 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 125.775 1.655 . . . . 0.0 111.049 169.664 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 79' ' ' ASN . 45.5 tp -167.04 -36.6 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.947 1.299 . . . . 0.0 112.919 -177.706 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -104.53 -9.43 18.34 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.01 1.324 . . . . 0.0 114.035 -173.996 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -97.23 -14.74 21.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.568 1.147 . . . . 0.0 113.412 -175.82 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -70.59 164.33 25.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.071 1.348 . . . . 0.0 111.942 170.07 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -121.9 167.72 12.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.294 1.045 . . . . 0.0 112.114 174.182 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.08 -25.52 43.07 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.397 1.079 . . . . 0.0 112.668 -178.421 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.7 m -64.41 -45.49 87.35 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.67 1.588 . . . . 0.0 112.208 -179.113 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -65.52 -36.93 85.27 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.611 -1.305 . . . . 0.0 112.231 176.826 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.27 -49.24 72.62 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.4 0.68 . . . . 0.0 111.818 172.35 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.3 p -64.98 -25.69 67.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.046 0.938 . . . . 0.0 113.312 -179.083 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -76.11 -35.61 59.22 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.159 1.384 . . . . 0.0 112.712 177.11 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.6 mmm-85 -100.13 -32.77 10.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.981 1.312 . . . . 0.0 113.452 -172.397 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.3 mt -86.8 -19.31 29.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.103 1.361 . . . . 0.0 112.829 173.194 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.63 57.73 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.277 1.431 . . . . 0.0 112.072 -176.09 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.8 pt -120.28 167.4 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 127.747 2.419 . . . . 0.0 109.928 175.828 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.2 t -70.91 151.42 44.73 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.392 -0.817 . . . . 0.0 110.747 165.679 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.79 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.006 0.922 . . . . 0.0 111.262 -177.41 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -67.46 -32.63 73.62 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 179.688 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.77 -35.29 76.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.206 171.911 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.25 -47.39 67.9 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.809 0.731 . . . . 0.0 110.636 175.726 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -57.04 -41.96 79.62 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.231 1.412 . . . . 0.0 112.831 179.249 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 t -83.86 -34.08 24.68 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.173 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -65.71 -36.19 82.9 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.972 -1.08 . . . . 0.0 112.32 176.899 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.7 mt -51.13 -60.44 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.098 0.959 . . . . 0.0 109.841 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -54.14 -26.9 30.14 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 127.472 2.309 . . . . 0.0 115.802 174.422 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -78.21 -13.33 59.9 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 176.774 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -99.66 -42.42 6.88 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.648 1.179 . . . . 0.0 111.652 160.307 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.432 ' HB2' HD11 ' A' ' 52' ' ' LEU . 46.1 t30 -79.78 79.53 6.27 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 127.221 2.209 . . . . 0.0 112.426 178.761 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.7 tpp85 -122.21 1.95 9.74 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -179.506 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 95.7 mmm -121.47 52.78 1.21 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.826 1.25 . . . . 0.0 111.542 -164.446 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.74 -125.1 0.84 Allowed Glycine 0 CA--C 1.526 0.752 0 C-N-CA 125.484 1.516 . . . . 0.0 109.962 -179.98 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 92.7 mtm-85 -72.91 2.92 5.93 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 -176.156 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m -72.5 11.41 0.62 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.504 1.522 . . . . 0.0 113.775 173.437 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 65.54 37.13 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 128.038 2.535 . . . . 0.0 111.868 166.002 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -78.29 -19.43 53.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.398 1.879 . . . . 0.0 114.942 -177.694 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -110.95 20.34 17.6 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.787 1.235 . . . . 0.0 112.78 -150.715 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -86.66 9.05 19.88 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 128.211 2.605 . . . . 0.0 114.721 -173.978 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.9 m -146.38 -49.32 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.439 1.895 . . . . 0.0 109.699 -169.327 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -80.86 155.38 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.411 1.485 . . . . 0.0 109.417 179.483 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? 64.04 14.19 8.3 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 126.011 1.724 . . . . 0.0 115.316 -178.6 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 20.9 mtm -115.48 -21.34 9.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 -178.048 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -129.27 -6.1 4.84 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -174.98 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -94.49 18.51 11.18 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.218 1.407 . . . . 0.0 113.018 -174.142 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -88.03 16.09 6.5 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.86 1.664 . . . . 0.0 114.852 -168.306 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -130.12 142.95 50.55 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.061 1.744 . . . . 0.0 111.388 176.446 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.0 t -127.91 -47.87 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 124.62 1.168 . . . . 0.0 111.737 -176.997 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.8 m -119.44 14.72 12.87 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.84 1.256 . . . . 0.0 113.576 -176.791 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 t -138.6 18.62 2.71 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.375 1.47 . . . . 0.0 114.02 -175.33 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.8 156.65 19.3 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.837 1.255 . . . . 0.0 112.568 177.322 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.4 m -134.7 160.46 38.08 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.558 1.543 . . . . 0.0 111.368 177.965 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -78.18 24.76 0.24 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.422 1.489 . . . . 0.0 114.502 -177.07 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 58.75 165.31 0.08 OUTLIER Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 128.651 2.781 . . . . 0.0 114.719 -174.148 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.0 67.89 5.85 Favored 'Trans proline' 0 CA--C 1.545 1.072 0 C-N-CA 123.768 2.979 . . . . 0.0 112.24 179.732 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -132.45 63.77 1.62 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.774 2.03 . . . . 0.0 110.39 -175.688 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.3 tp -118.39 80.32 16.14 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.588 1.555 . . . . 0.0 110.767 -177.9 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.253 1.233 0 C-N-CA 123.959 3.106 . . . . 0.0 113.296 -179.765 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 112.031 -0.427 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 13.5 t -147.77 154.2 40.21 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.374 1.47 . . . . 0.0 111.243 175.653 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -143.82 117.42 9.19 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.69 1.196 . . . . 0.0 110.621 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 96.3 mtp -138.2 74.9 1.5 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.062 1.345 . . . . 0.0 110.777 -179.522 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 60.6 -35.16 0.08 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 128.978 2.911 . . . . 0.0 117.322 -174.716 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 59.5 p 57.31 -46.11 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.916 1 C-N-CA 132.318 4.247 . . . . 0.0 117.002 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -104.65 -2.41 25.07 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.79 1.636 . . . . 0.0 115.018 -172.0 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -111.97 6.81 19.63 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.397 1.479 . . . . 0.0 113.743 -179.127 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -138.43 23.11 2.73 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 115.297 1.591 . . . . 0.0 115.297 -168.273 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 85.8 mt -124.14 72.36 1.17 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.666 1.586 . . . . 0.0 111.934 -176.188 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -133.05 -5.79 3.08 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 114.998 1.481 . . . . 0.0 114.998 -174.38 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -101.63 89.27 3.65 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.72 1.208 . . . . 0.0 111.211 -179.002 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.5 mp -130.7 96.44 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.179 1.392 . . . . 0.0 108.909 178.79 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.1 mt -136.77 141.16 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 125.499 1.519 . . . . 0.0 109.892 -175.62 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -133.62 59.57 1.73 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.752 1.621 . . . . 0.0 110.831 179.87 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -137.09 -73.36 0.43 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.942 1.297 . . . . 0.0 111.443 -178.518 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.0 tt -144.06 118.09 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 126.112 1.765 . . . . 0.0 108.982 176.834 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -161.01 173.29 15.45 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.794 2.037 . . . . 0.0 109.662 -172.721 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -52.13 -29.59 22.57 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.34 1.456 . . . . 0.0 114.287 -177.004 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -104.14 20.05 19.0 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -177.492 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.9 -69.08 0.12 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.437 1.495 . . . . 0.0 114.216 176.993 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 68.7 mt -130.04 -8.45 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.753 1.221 . . . . 0.0 113.258 -171.475 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -71.58 -16.95 62.32 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -171.917 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -83.04 -45.94 13.43 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.15 0.98 . . . . 0.0 113.121 179.781 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -80.97 -17.01 51.9 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -171.351 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 74.5 t -77.01 -32.06 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.444 1.098 . . . . 0.0 111.859 179.603 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.7 t -104.78 62.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.082 1.353 . . . . 0.0 110.066 -176.805 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.7 tp -146.75 145.05 29.82 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.201 1.4 . . . . 0.0 111.449 -176.427 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.45 38.32 4.12 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.512 1.525 . . . . 0.0 113.369 -178.077 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.6 t30 47.12 64.19 8.9 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 126.763 2.025 . . . . 0.0 113.741 178.939 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -80.14 67.22 8.69 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 124.208 3.272 . . . . 0.0 113.917 -167.792 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -139.85 -57.66 0.56 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.027 1.731 . . . . 0.0 112.223 173.207 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.3 p -153.66 118.35 2.76 Favored Pre-proline 0 CA--C 1.543 0.696 0 C-N-CA 125.329 1.451 . . . . 0.0 110.864 -177.771 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -89.16 172.39 4.29 Favored 'Trans proline' 0 CA--C 1.536 0.588 0 C-N-CA 123.901 3.068 . . . . 0.0 113.067 173.491 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.8 p -136.84 88.92 2.4 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.98 1.712 . . . . 0.0 111.076 -164.151 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -120.82 25.7 9.53 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.946 1.699 . . . . 0.0 114.296 -176.052 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -81.09 51.63 1.62 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.851 1.66 . . . . 0.0 112.539 -174.418 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.7 t -139.07 8.52 2.5 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.667 1.587 . . . . 0.0 113.902 -165.883 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.02 -32.58 73.29 Favored Glycine 0 CA--C 1.537 1.434 0 O-C-N 120.683 -1.261 . . . . 0.0 115.285 -171.847 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.26 17.57 3.42 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.844 1.258 . . . . 0.0 113.303 -176.876 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp -135.87 132.64 36.83 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.556 1.543 . . . . 0.0 110.747 177.097 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 62.6 m -115.88 -68.98 0.88 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.162 1.785 . . . . 0.0 112.27 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -163.82 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 123.452 0.701 . . . . 0.0 111.443 -171.004 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -68.56 -28.83 67.31 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.547 1.139 . . . . 0.0 110.264 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -72.81 -34.89 67.16 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.475 1.11 . . . . 0.0 112.062 178.667 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -70.4 -34.98 73.16 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.848 -1.158 . . . . 0.0 112.491 173.085 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -60.89 -6.32 1.76 Allowed 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 168.724 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.3 mt -108.13 -56.79 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.84 1.656 . . . . 0.0 110.342 169.419 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.1 t -69.18 -61.79 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 123.856 0.862 . . . . 0.0 111.373 -173.599 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.38 70.56 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.358 0.663 . . . . 0.0 111.829 -177.097 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.06 -44.61 87.56 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 122.889 0.475 . . . . 0.0 112.197 167.681 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -36.75 80.92 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.992 0.917 . . . . 0.0 112.257 175.329 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.1 mm -60.56 -28.32 42.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.772 -1.205 . . . . 0.0 110.655 175.664 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -77.14 -14.75 59.74 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 173.074 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -93.74 -54.28 3.69 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.398 -1.439 . . . . 0.0 112.115 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.3 m -118.63 -13.17 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -164.709 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.7 -77.31 0.4 Allowed Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.365 1.46 . . . . 0.0 112.106 166.438 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.9 tp -163.66 -43.5 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.321 1.449 . . . . 0.0 111.854 170.758 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -108.96 -5.6 16.03 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -167.606 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -89.7 -17.71 27.82 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.037 0.935 . . . . 0.0 112.993 -176.956 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.36 164.46 9.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.802 1.241 . . . . 0.0 112.528 165.863 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -110.36 167.01 10.52 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 122.292 1.044 . . . . 0.0 111.466 171.423 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.04 -24.25 37.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.145 0.978 . . . . 0.0 112.412 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.39 -45.25 93.96 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.192 1.797 . . . . 0.0 112.519 -179.49 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -65.26 -41.82 93.88 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.639 -1.288 . . . . 0.0 111.989 176.951 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.52 -46.06 90.13 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.657 -0.652 . . . . 0.0 111.912 174.235 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.7 p -65.37 -23.47 66.98 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.182 -0.949 . . . . 0.0 113.402 179.366 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.03 1.332 . . . . 0.0 112.389 176.253 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -102.74 -40.22 6.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.363 1.465 . . . . 0.0 113.072 -169.944 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.4 mp -81.03 -17.77 49.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.606 1.162 . . . . 0.0 113.207 170.304 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.92 58.24 2.83 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-O 122.693 1.235 . . . . 0.0 111.49 -175.282 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.1 pt -122.79 164.56 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 128.011 2.524 . . . . 0.0 109.532 177.024 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 t -70.64 153.49 42.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 121.243 -0.91 . . . . 0.0 110.766 167.568 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -58.3 -37.69 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.869 0.868 . . . . 0.0 111.167 -177.366 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.62 -29.99 68.62 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 179.396 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -67.3 -38.36 84.85 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.096 170.338 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.66 -48.12 67.56 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.632 0.651 . . . . 0.0 110.329 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -56.47 -32.41 64.94 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.95 1.7 . . . . 0.0 113.987 178.751 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -90.25 -42.05 11.22 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.968 0.804 . . . . 0.0 112.822 173.454 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.6 -35.77 72.96 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.899 -1.126 . . . . 0.0 113.333 -178.393 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.6 mt -50.37 -42.47 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 0.0 112.25 174.231 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -94.59 -25.76 16.66 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 176.396 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -68.87 -32.67 72.5 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.819 0.736 . . . . 0.0 112.952 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.0 t -87.69 -35.02 18.2 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.463 1.105 . . . . 0.0 113.749 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -108.76 -35.17 6.47 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -170.711 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 45.61 53.67 8.33 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 127.97 2.508 . . . . 0.0 113.326 -178.637 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 60.8 mtt 62.33 -39.57 0.15 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 128.902 2.881 . . . . 0.0 115.818 -171.726 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 178.05 37.08 0.06 OUTLIER Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.106 1.812 . . . . 0.0 112.571 176.386 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 60.2 mtt-85 48.39 70.27 0.47 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.92 2.088 . . . . 0.0 114.604 -171.469 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 41.1 p 54.41 41.97 31.67 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 123.247 1.499 . . . . 0.0 113.332 163.792 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -84.58 -8.0 59.06 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.457 2.303 . . . . 0.0 112.002 -173.998 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.4 -17.59 59.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 128.389 2.676 . . . . 0.0 113.163 176.666 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -71.52 15.69 0.13 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.015 2.126 . . . . 0.0 115.81 -174.709 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' A' ' 88' ' ' LYS . 31.6 mtmt -66.82 100.12 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.318 -1.489 . . . . 0.0 109.573 -176.085 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 75.79 2.58 3.72 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.385 2.674 . . . . 0.0 114.827 -176.623 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.2 mt -117.66 145.72 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.898 1.279 . . . . 0.0 109.993 -175.464 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 60.52 14.27 4.75 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.643 1.577 . . . . 0.0 114.344 -169.777 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.7 ptm -138.01 9.69 2.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.984 1.713 . . . . 0.0 114.02 -178.696 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -145.69 -36.05 0.29 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.03 1.492 . . . . 0.0 115.03 -163.099 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -76.33 146.51 38.77 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.355 -0.84 . . . . 0.0 112.9 -175.266 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -98.15 160.98 13.95 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.302 1.441 . . . . 0.0 112.535 177.124 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -71.42 137.3 48.2 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.722 0.809 . . . . 0.0 112.042 172.615 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.2 t -125.07 -38.25 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 125.001 1.32 . . . . 0.0 111.813 178.54 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.7 t -130.3 34.13 4.24 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.376 1.47 . . . . 0.0 112.273 179.818 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 81.1 p 47.85 36.08 5.55 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 127.278 2.231 . . . . 0.0 116.126 174.021 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.47 100.46 2.22 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.489 1.116 . . . . 0.0 112.091 -177.062 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.1 t -154.14 168.62 25.89 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.83 1.652 . . . . 0.0 111.394 -179.532 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.5 38.42 0.49 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.297 1.839 . . . . 0.0 113.395 -175.853 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 47.95 64.86 7.86 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 127.135 2.174 . . . . 0.0 113.382 -179.513 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -77.96 47.85 2.47 Favored 'Trans proline' 0 CA--C 1.545 1.048 1 C-N-CA 125.347 4.031 . . . . 0.0 113.179 -175.232 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -82.56 64.02 7.0 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.458 1.903 . . . . 0.0 111.81 -175.001 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 6.0 mp -116.85 74.41 6.73 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 125.723 1.609 . . . . 0.0 110.754 178.145 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.255 1.325 0 C-N-CA 123.942 3.095 . . . . 0.0 113.254 178.765 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 111.551 -0.62 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 60.5 p -139.71 163.64 32.06 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.839 1.656 . . . . 0.0 112.099 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -139.51 129.84 25.44 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.45 1.1 . . . . 0.0 111.531 178.254 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 95.0 mmm -129.17 106.12 8.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.737 1.615 . . . . 0.0 109.906 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.68 -64.61 0.43 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.559 1.144 . . . . 0.0 112.743 178.457 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.8 m 55.77 12.45 0.85 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.77 2.137 . . . . 0.0 116.77 177.024 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm -139.98 -15.69 1.0 Allowed 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -175.081 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -107.62 2.7 24.12 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.781 1.632 . . . . 0.0 112.422 173.386 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.72 55.71 0.96 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.501 1.52 . . . . 0.0 111.253 -166.024 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.31 165.74 25.06 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.335 1.454 . . . . 0.0 113.182 173.556 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.0 t0 55.8 42.18 29.37 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.168 1.787 . . . . 0.0 114.213 175.683 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -119.95 15.76 12.52 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.063 1.745 . . . . 0.0 114.27 -171.347 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.8 mp -81.26 67.46 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 125.141 1.376 . . . . 0.0 111.326 -172.456 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.5 tp -140.43 -10.55 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 125.14 1.376 . . . . 0.0 113.883 -177.534 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -98.01 48.12 1.01 Allowed 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.65 -1.281 . . . . 0.0 113.828 -165.763 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -137.71 -46.57 0.54 Allowed 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 179.41 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.7 pt -132.72 113.08 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.868 1.267 . . . . 0.0 110.751 -178.907 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.62 -176.97 6.19 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 128.065 2.546 . . . . 0.0 109.342 -176.761 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.6 mttp -67.48 94.3 0.4 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.077 0.951 . . . . 0.0 112.43 178.813 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.91 151.09 48.67 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.586 1.954 . . . . 0.0 110.394 165.448 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.87 26.96 2.03 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.524 1.53 . . . . 0.0 112.835 -173.708 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt 52.54 53.91 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-O 124.413 2.054 . . . . 0.0 110.425 -168.999 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.8 p-10 -121.9 -3.84 9.14 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.637 2.775 . . . . 0.0 112.671 -169.311 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.1 m -119.38 -39.75 2.86 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.739 1.215 . . . . 0.0 113.515 -178.181 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.8 p-10 -77.67 -22.15 51.02 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.231 1.412 . . . . 0.0 114.379 179.81 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 74.3 t -88.09 -32.56 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.565 1.546 . . . . 0.0 111.256 174.957 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.4 t -90.94 61.2 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.083 1.353 . . . . 0.0 110.222 -178.469 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.1 mt -121.27 146.45 46.81 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.194 1.797 . . . . 0.0 111.743 176.052 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -123.97 48.02 1.96 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.538 1.935 . . . . 0.0 111.726 -175.579 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 t30 48.4 73.85 0.92 Allowed Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 126.702 2.001 . . . . 0.0 113.292 178.917 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -72.66 84.17 1.26 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 123.928 3.085 . . . . 0.0 112.771 -171.341 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.6 mmt180 50.15 32.67 6.2 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 126.9 2.08 . . . . 0.0 114.855 176.402 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 87.7 t 50.15 102.85 0.03 OUTLIER Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 129.027 2.931 . . . . 0.0 112.732 -170.058 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.13 169.32 20.9 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.411 2.074 . . . . 0.0 112.349 176.72 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.1 p -76.0 33.69 0.12 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 127.309 2.243 . . . . 0.0 116.294 -164.8 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -122.97 65.46 0.97 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.369 1.467 . . . . 0.0 112.177 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.85 33.36 5.6 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 126.254 1.821 . . . . 0.0 111.879 179.076 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.6 t -145.22 13.28 1.41 Allowed 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.174 1.39 . . . . 0.0 113.669 -167.429 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.6 -38.47 90.3 Favored Glycine 0 CA--C 1.538 1.49 0 O-C-N 120.488 -1.383 . . . . 0.0 115.164 -169.362 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -148.58 3.33 0.65 Allowed 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -175.85 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp -105.56 112.61 25.76 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.239 1.816 . . . . 0.0 110.167 179.305 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -93.08 -78.41 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 125.489 1.516 . . . . 0.0 111.188 170.231 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -156.56 -46.13 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 122.971 0.508 . . . . 0.0 111.156 -172.978 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -65.83 -29.72 70.23 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.438 0.695 . . . . 0.0 111.683 175.542 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -73.63 -45.9 50.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.954 0.901 . . . . 0.0 111.866 -169.273 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -67.12 -28.14 67.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.221 1.009 . . . . 0.0 112.63 169.926 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -69.74 -1.74 10.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.803 1.241 . . . . 0.0 114.087 170.045 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -106.54 -53.76 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.149 1.38 . . . . 0.0 109.932 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.5 t -72.39 -59.15 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.092 0.86 . . . . 0.0 112.066 -174.694 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.87 64.48 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.495 0.589 . . . . 0.0 112.294 -177.41 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.18 -44.56 94.96 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.661 -0.65 . . . . 0.0 112.392 164.633 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.93 -34.31 77.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.053 0.842 . . . . 0.0 111.945 175.582 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -61.52 -22.66 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 O-C-N 120.559 -1.338 . . . . 0.0 112.023 174.154 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 t -83.63 -12.79 55.53 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.557 1.143 . . . . 0.0 114.065 171.952 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -93.41 -56.37 2.96 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.635 -1.291 . . . . 0.0 112.284 -175.607 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.3 m -122.94 -17.23 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 -165.611 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 130.45 -89.08 0.3 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 125.758 1.647 . . . . 0.0 110.413 172.711 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 54.3 tp -163.72 -36.33 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.101 1.36 . . . . 0.0 113.066 177.921 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -107.68 -2.66 19.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -173.287 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -94.91 -17.84 21.66 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.241 1.016 . . . . 0.0 112.955 178.771 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -73.43 164.41 26.7 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.336 1.454 . . . . 0.0 111.924 169.634 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.9 p30 -115.39 172.61 6.99 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.194 0.997 . . . . 0.0 111.653 170.828 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.79 -21.36 29.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.427 1.091 . . . . 0.0 112.611 178.571 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.0 m -63.25 -50.19 71.16 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.892 1.677 . . . . 0.0 111.643 -178.346 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -66.37 -45.53 79.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.829 -1.169 . . . . 0.0 112.276 -179.296 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -52.29 -54.31 32.96 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.504 1.122 . . . . 0.0 112.241 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.4 p -66.88 -27.99 67.96 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -177.599 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -70.8 -46.76 62.25 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.086 1.355 . . . . 0.0 112.637 173.324 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 66.1 mtt85 -78.46 -40.61 35.12 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.21 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -85.45 -19.01 31.92 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.395 1.478 . . . . 0.0 111.747 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.23 66.52 0.71 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.0 1.72 . . . . 0.0 111.92 179.069 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -132.37 172.75 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 127.004 2.121 . . . . 0.0 110.956 178.907 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 55.0 m -66.05 137.72 57.28 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.226 1.41 . . . . 0.0 109.05 165.625 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.7 t -57.41 -38.97 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 O-C-N 121.716 -0.615 . . . . 0.0 110.984 -179.131 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.87 -26.53 64.24 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.815 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -66.78 -39.49 87.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.566 -0.73 . . . . 0.0 111.268 169.526 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.53 -45.72 74.91 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.901 0.773 . . . . 0.0 110.299 175.031 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -54.79 -42.24 71.52 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.765 1.226 . . . . 0.0 112.608 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -83.4 -38.06 22.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 176.948 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.62 -33.75 75.63 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.067 -1.021 . . . . 0.0 113.277 -178.503 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -49.13 -47.0 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.988 1.315 . . . . 0.0 111.418 172.58 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -87.32 -26.88 23.17 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 175.694 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -66.98 -33.16 74.97 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.192 0.906 . . . . 0.0 112.632 -179.29 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.7 t -93.12 -39.52 11.0 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -178.398 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -100.19 -30.14 12.08 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -173.866 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 17.5 tpt85 46.36 53.59 9.45 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 128.151 2.58 . . . . 0.0 114.128 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 25.9 mmt 64.53 -28.39 0.1 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 128.122 2.569 . . . . 0.0 116.224 -176.359 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 158.06 -45.68 0.47 Allowed Glycine 0 N--CA 1.471 0.996 0 C-N-CA 124.711 1.148 . . . . 0.0 111.031 164.578 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 94.0 mtt-85 -124.57 -84.65 0.64 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.063 1.745 . . . . 0.0 110.319 163.647 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 72.3 p -145.51 20.6 1.52 Allowed 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -164.441 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 57.3 40.56 27.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.739 1.615 . . . . 0.0 111.616 -171.676 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -82.05 -19.07 41.04 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.536 1.535 . . . . 0.0 114.865 -174.849 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -116.06 10.61 15.09 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -141.824 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -85.12 -6.53 59.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.354 1.862 . . . . 0.0 115.02 -167.53 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.1 m -144.45 -46.39 0.25 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.709 1.603 . . . . 0.0 110.993 -164.094 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.2 pt -75.93 174.37 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.044 1.338 . . . . 0.0 111.889 175.128 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 65.21 -15.69 0.1 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 127.18 2.192 . . . . 0.0 116.16 -175.039 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.0 ptm -123.85 1.13 8.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.708 1.603 . . . . 0.0 114.241 -176.757 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -134.2 -9.59 2.6 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -166.13 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -104.94 94.25 5.15 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.849 1.26 . . . . 0.0 110.813 -173.76 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -150.22 159.17 44.63 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.231 1.412 . . . . 0.0 111.53 179.667 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -76.29 140.56 41.58 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.265 1.026 . . . . 0.0 112.681 178.213 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.7 t -131.25 -45.8 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.242 1.417 . . . . 0.0 111.069 176.157 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.7 m -122.79 30.95 6.23 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.695 1.598 . . . . 0.0 112.558 -179.196 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.9 m 47.17 56.47 6.82 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.918 2.087 . . . . 0.0 114.423 175.86 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.06 101.43 0.87 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.585 1.154 . . . . 0.0 111.896 -177.363 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.1 t -157.69 169.8 23.81 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.98 1.712 . . . . 0.0 111.129 -176.66 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -79.08 32.57 0.22 Allowed 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.154 1.781 . . . . 0.0 113.937 179.338 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 59.93 156.29 0.1 Allowed Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 129.533 3.133 . . . . 0.0 115.876 -175.031 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -76.89 83.91 2.02 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.704 2.936 . . . . 0.0 111.761 -176.234 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -126.88 32.97 5.02 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.668 1.587 . . . . 0.0 112.79 -175.391 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.8 tt -133.22 70.26 77.71 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 125.326 1.45 . . . . 0.0 110.576 176.452 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--O 1.254 1.287 0 C-N-CA 123.987 3.125 . . . . 0.0 113.255 179.319 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 112.179 -0.368 . . . . 0.0 112.179 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 88.6 p -144.59 163.35 34.16 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.555 1.542 . . . . 0.0 112.273 179.687 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.5 t-160 -133.02 33.5 3.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.933 1.293 . . . . 0.0 112.618 -174.275 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 90.7 mtp -84.59 66.51 9.57 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.098 1.359 . . . . 0.0 111.315 -176.932 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.35 90.4 2.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.895 1.678 . . . . 0.0 110.833 -176.45 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.7 t -137.97 17.07 2.83 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.076 1.35 . . . . 0.0 114.199 -171.274 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt -129.25 -26.87 2.52 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 115.127 1.529 . . . . 0.0 115.127 -175.969 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -109.63 -26.22 10.01 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.881 1.672 . . . . 0.0 112.414 176.094 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.6 tt0 -90.1 -43.23 10.62 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.146 1.378 . . . . 0.0 111.85 178.26 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.9 mp -99.36 133.48 43.6 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.972 1.309 . . . . 0.0 109.774 175.701 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -155.0 -52.73 0.09 Allowed 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 174.6 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -109.17 22.92 15.24 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.006 1.323 . . . . 0.0 113.416 -167.576 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.4 mm -84.86 60.22 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.387 1.475 . . . . 0.0 110.871 -166.337 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 25.3 mt -136.21 -42.92 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 126.302 1.841 . . . . 0.0 110.896 -175.954 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -135.57 166.82 22.34 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.569 1.548 . . . . 0.0 111.985 -177.76 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -131.66 163.04 29.0 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.585 1.554 . . . . 0.0 111.49 -176.746 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.6 pt -115.91 113.21 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 126.492 1.917 . . . . 0.0 111.41 -171.601 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -147.64 31.89 0.88 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.832 1.653 . . . . 0.0 113.682 -176.15 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 60.68 6.44 1.14 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 127.209 2.204 . . . . 0.0 116.523 -177.689 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -148.88 148.05 29.41 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.021 1.728 . . . . 0.0 110.125 172.526 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.92 -78.64 0.14 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.843 1.257 . . . . 0.0 111.482 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.3 mp -125.9 -16.54 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.005 1.322 . . . . 0.0 114.007 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -69.12 -17.68 63.87 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -165.682 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 m -91.29 -46.4 8.07 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.36 1.064 . . . . 0.0 112.477 175.656 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -79.23 -15.17 58.43 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -175.018 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.8 p -76.03 -15.86 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 123.835 0.854 . . . . 0.0 112.773 175.311 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.6 t -115.48 68.23 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 125.792 1.637 . . . . 0.0 110.276 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.77 22.66 6.81 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.34 1.456 . . . . 0.0 113.649 -173.652 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -100.14 45.84 0.97 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.631 2.772 . . . . 0.0 110.986 -174.153 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.6 t30 49.2 61.55 13.77 Favored Pre-proline 0 CA--C 1.557 1.235 0 C-N-CA 127.434 2.294 . . . . 0.0 113.797 -176.381 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -81.91 40.73 1.01 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 124.803 3.668 . . . . 0.0 114.41 -167.547 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.6 ptt85 -137.7 -21.68 1.12 Allowed 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -169.026 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.5 t 33.94 79.6 0.28 Allowed Pre-proline 0 N--CA 1.485 1.294 0 C-N-CA 128.551 2.74 . . . . 0.0 114.292 173.127 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.96 170.91 16.86 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.073 2.515 . . . . 0.0 113.437 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.8 p -112.81 51.71 0.81 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.176 1.79 . . . . 0.0 113.94 -163.16 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -77.38 29.02 0.15 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 116.037 1.865 . . . . 0.0 116.037 -178.012 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.42 66.82 8.2 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.849 2.059 . . . . 0.0 111.387 178.666 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 t -145.79 12.52 1.29 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 -172.055 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.04 -89.1 1.03 Allowed Glycine 0 CA--C 1.529 0.927 0 O-C-N 120.761 -1.212 . . . . 0.0 112.628 -176.517 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -139.11 28.67 2.29 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.775 1.23 . . . . 0.0 113.255 -168.05 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp -131.51 130.8 42.84 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.943 1.297 . . . . 0.0 111.208 176.836 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.4 t -112.86 -77.22 0.58 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 127.42 2.288 . . . . 0.0 111.544 179.53 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -155.7 -40.98 0.08 Allowed 'General case' 0 C--N 1.327 -0.41 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -67.7 -28.76 67.95 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.546 0.739 . . . . 0.0 111.008 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.6 mp0 -71.84 -32.4 67.49 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.812 -0.555 . . . . 0.0 112.35 179.574 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mttt -70.08 -34.84 73.68 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 120.889 -1.132 . . . . 0.0 112.779 170.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -64.46 0.48 1.04 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 169.115 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -112.54 -52.2 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 126.531 1.932 . . . . 0.0 110.924 167.492 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 64.0 t -74.05 -59.97 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.905 0.775 . . . . 0.0 112.275 -175.061 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.05 -28.78 68.49 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.35 -11.32 40.92 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 167.874 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.04 -36.88 11.36 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.212 1.405 . . . . 0.0 111.299 167.132 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.7 mm -63.72 -27.55 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 O-C-N 120.518 -1.364 . . . . 0.0 112.027 178.915 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.0 p -68.43 -19.83 64.61 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 168.336 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -106.96 -42.06 5.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.173 0.897 . . . . 0.0 113.168 -157.526 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -128.03 -14.67 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.741 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.76 -93.33 0.29 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 125.821 1.677 . . . . 0.0 110.173 173.913 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -164.0 -28.78 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.636 1.574 . . . . 0.0 113.372 175.666 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -108.35 -12.91 14.98 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 114.603 -172.007 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -91.89 -20.18 21.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.121 0.968 . . . . 0.0 112.938 -175.857 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.0 pp -67.87 164.0 20.7 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.637 1.575 . . . . 0.0 112.187 166.62 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.06 171.25 7.78 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.374 1.083 . . . . 0.0 111.946 172.276 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -20.75 32.37 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.102 1.361 . . . . 0.0 113.005 -179.166 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.9 m -67.74 -46.99 70.55 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.835 1.654 . . . . 0.0 111.807 -178.564 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -65.8 -45.13 83.52 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.114 -0.991 . . . . 0.0 112.041 178.769 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -52.48 -56.34 15.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.085 0.554 . . . . 0.0 112.103 168.969 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.8 p -64.69 -21.84 66.84 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.235 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -74.03 -48.66 28.51 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.591 1.557 . . . . 0.0 112.187 173.377 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -76.11 -39.42 55.24 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.89 0.876 . . . . 0.0 112.636 179.762 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.3 mt -81.72 -21.99 37.61 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.094 1.357 . . . . 0.0 113.164 -179.125 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.65 58.5 2.85 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.335 1.454 . . . . 0.0 111.991 -176.764 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.4 pt -123.71 178.44 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 127.68 2.392 . . . . 0.0 109.644 175.358 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -76.59 147.88 37.34 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.494 -0.754 . . . . 0.0 110.843 164.438 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.2 t -53.76 -35.13 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.109 1.363 . . . . 0.0 110.982 175.189 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.25 -24.22 62.13 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 -176.205 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -78.19 -37.4 45.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.081 0.855 . . . . 0.0 111.253 168.934 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.28 -47.85 75.24 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.701 0.682 . . . . 0.0 110.132 -179.094 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -64.43 -30.78 71.81 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -175.448 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -89.99 -33.25 16.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.906 0.776 . . . . 0.0 112.709 174.899 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.09 -37.09 85.81 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.067 -1.021 . . . . 0.0 112.483 177.772 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -50.32 -63.12 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.361 1.064 . . . . 0.0 110.22 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -63.63 -29.76 70.96 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -179.744 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -67.38 -23.09 65.55 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.065 0.848 . . . . 0.0 112.885 174.722 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.4 t -82.91 -53.7 5.65 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.915 0.886 . . . . 0.0 111.87 167.771 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.81 91.17 3.52 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.137 1.375 . . . . 0.0 112.875 -170.707 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.98 7.96 9.29 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 126.464 1.906 . . . . 0.0 115.088 -179.385 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.8 mtm -79.12 -22.13 45.6 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -167.291 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.59 90.34 2.13 Favored Glycine 0 N--CA 1.472 1.046 0 C-N-CA 125.66 1.6 . . . . 0.0 111.101 -179.591 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 49.6 mtm-85 31.8 61.97 0.28 Allowed 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 127.384 2.274 . . . . 0.0 113.877 -171.422 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.6 p 52.91 19.18 1.25 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.873 1.669 . . . . 0.0 114.991 177.024 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 46.95 34.14 2.57 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 126.467 1.907 . . . . 0.0 113.564 -167.254 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.4 -9.01 19.76 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -177.475 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -71.48 14.87 0.15 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 127.074 2.149 . . . . 0.0 115.516 -172.805 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -92.23 -4.55 53.93 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.982 2.513 . . . . 0.0 115.048 -166.025 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 57.2 m -145.77 -46.12 0.21 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.103 1.761 . . . . 0.0 110.475 -168.544 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.4 pt -64.65 167.16 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.57 1.148 . . . . 0.0 111.575 173.902 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 67.07 -9.9 0.35 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 126.496 1.919 . . . . 0.0 115.928 -176.669 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -143.59 19.65 1.85 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.659 1.118 . . . . 0.0 113.792 -176.674 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -152.49 -40.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.424 1.089 . . . . 0.0 112.921 -176.144 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -81.12 159.9 24.57 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.847 1.259 . . . . 0.0 112.699 175.742 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -133.78 161.42 34.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.058 1.743 . . . . 0.0 111.745 176.573 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -122.61 153.33 39.45 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.679 1.592 . . . . 0.0 111.498 177.39 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -82.1 -20.7 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.417 1.087 . . . . 0.0 112.237 -175.317 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.7 t 59.33 31.41 21.11 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.613 1.165 . . . . 0.0 112.447 -162.811 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.9 t -144.01 139.15 28.86 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.698 1.599 . . . . 0.0 111.033 173.304 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -154.18 171.69 18.78 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.922 1.689 . . . . 0.0 111.296 -175.391 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 57.4 m -124.28 177.24 5.96 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.051 1.341 . . . . 0.0 111.14 -176.795 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.12 -18.06 56.03 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 176.775 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -139.22 98.19 8.37 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.529 1.931 . . . . 0.0 110.264 167.654 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -74.22 121.56 6.95 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.074 2.516 . . . . 0.0 110.051 173.375 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -134.4 40.66 2.99 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.199 1.4 . . . . 0.0 112.031 -173.57 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.8 tt -120.6 89.53 44.75 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.774 1.63 . . . . 0.0 109.605 -177.707 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo . . . . . 0 C--O 1.254 1.276 0 C-N-CA 124.025 3.15 . . . . 0.0 113.331 -177.848 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.506 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 27.1 m -67.39 159.23 29.88 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.769 1.228 . . . . 0.0 113.628 -179.425 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -127.74 148.41 50.42 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.824 1.65 . . . . 0.0 111.307 173.755 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 31.7 ttm -136.92 37.33 2.59 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.28 1.432 . . . . 0.0 112.596 -175.145 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -124.08 -59.69 1.48 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.684 1.593 . . . . 0.0 111.777 178.035 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.34 17.68 3.0 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 174.997 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.2 mtp -146.9 -13.69 0.42 Allowed 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -179.456 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -114.11 4.96 15.81 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.747 1.619 . . . . 0.0 112.761 178.302 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.65 39.79 0.73 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.03 1.332 . . . . 0.0 112.285 -163.518 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -109.53 127.16 54.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.384 1.474 . . . . 0.0 110.934 178.799 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -156.57 15.99 0.31 Allowed 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -173.34 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -122.18 17.03 10.74 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 120.539 -1.351 . . . . 0.0 114.454 -167.841 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 82.6 mt -98.87 98.56 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.96 1.304 . . . . 0.0 110.034 -165.952 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 6.1 mt -138.87 54.32 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 125.172 1.389 . . . . 0.0 110.669 -172.892 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -135.18 50.78 2.12 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.061 1.344 . . . . 0.0 112.29 -176.099 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -144.77 130.15 18.78 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.581 1.152 . . . . 0.0 112.719 -174.402 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.3 pp -150.53 145.75 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 127.713 2.405 . . . . 0.0 111.079 177.859 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -129.59 26.68 5.31 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.481 1.912 . . . . 0.0 113.946 -178.846 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm 51.83 60.29 3.95 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.792 -1.193 . . . . 0.0 111.943 -172.496 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -57.77 107.14 0.42 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.585 1.554 . . . . 0.0 112.844 -173.829 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -92.93 43.44 1.12 Allowed 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.158 -1.383 . . . . 0.0 113.504 -164.247 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.8 mt 52.89 40.22 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 125.687 1.595 . . . . 0.0 110.888 -168.767 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.4 p30 -107.82 -9.28 15.79 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.897 1.679 . . . . 0.0 112.808 -179.486 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 51.7 p -113.04 -51.67 2.82 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.404 1.481 . . . . 0.0 112.568 -171.953 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -66.76 -23.39 66.07 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.749 1.62 . . . . 0.0 114.813 -179.638 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 69.2 t -90.82 -25.28 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.544 1.538 . . . . 0.0 112.041 175.845 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.4 t -117.66 62.2 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 125.327 1.451 . . . . 0.0 110.371 -172.11 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 tp -142.43 138.69 31.25 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.759 1.224 . . . . 0.0 111.684 179.319 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 tttt -139.14 33.22 2.13 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.072 1.749 . . . . 0.0 112.946 -177.096 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 t30 46.41 67.29 4.51 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 126.967 2.107 . . . . 0.0 113.688 -177.601 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -77.74 45.52 1.79 Allowed 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 124.898 3.732 . . . . 0.0 114.338 -170.969 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.7 mmt85 -134.28 27.22 3.8 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 127.632 2.373 . . . . 0.0 113.64 -172.43 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.1 t -115.11 78.41 5.69 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 125.444 1.497 . . . . 0.0 111.415 178.086 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -80.74 165.21 20.23 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.817 3.011 . . . . 0.0 112.87 174.784 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 p -86.57 56.86 4.19 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.49 1.516 . . . . 0.0 112.048 171.11 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 56.07 31.64 18.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.229 1.812 . . . . 0.0 114.097 174.219 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.91 35.45 1.15 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.066 1.747 . . . . 0.0 113.401 -171.378 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.1 t -147.03 19.52 1.25 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.534 1.133 . . . . 0.0 113.725 -165.859 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.7 -69.92 1.3 Allowed Glycine 0 CA--C 1.533 1.162 0 O-C-N 120.567 -1.333 . . . . 0.0 112.895 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -136.97 -63.4 0.61 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.101 1.36 . . . . 0.0 111.439 177.636 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 mp -114.19 115.46 27.51 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 127.19 2.196 . . . . 0.0 109.593 179.848 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 85.1 p -97.76 -71.4 0.69 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.641 1.176 . . . . 0.0 111.667 169.026 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -163.67 -34.31 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 124.575 1.15 . . . . 0.0 111.666 -168.354 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.83 -32.81 46.32 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.819 -0.55 . . . . 0.0 111.705 173.742 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -75.09 -39.16 60.94 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.174 -0.954 . . . . 0.0 112.527 -170.077 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -67.66 -28.51 67.76 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.27 -0.894 . . . . 0.0 112.406 172.787 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -67.5 -6.88 21.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 168.476 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -101.56 -39.72 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.012 1.325 . . . . 0.0 111.052 170.825 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.6 t -90.48 -54.15 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 119.059 0.845 . . . . 0.0 113.141 -174.563 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.14 -35.66 81.5 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.104 0.865 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.26 -33.43 71.03 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.22 -38.09 60.83 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.095 -1.003 . . . . 0.0 111.767 176.442 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -61.84 -26.99 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 120.858 -1.151 . . . . 0.0 111.229 173.009 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.4 m -79.51 -12.13 59.88 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 170.187 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.7 -39.5 6.32 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.622 1.101 . . . . 0.0 112.821 -172.462 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -132.64 -15.53 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -171.58 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.37 -82.1 0.34 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 125.417 1.484 . . . . 0.0 111.62 171.377 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 35.6 tp -171.66 -34.51 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.471 1.908 . . . . 0.0 111.236 177.026 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -107.69 -5.59 17.33 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -167.05 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -99.09 -22.46 15.68 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.99 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -62.65 157.94 19.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.917 1.287 . . . . 0.0 112.612 171.02 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.56 172.67 6.78 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.493 1.139 . . . . 0.0 112.094 177.617 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -18.55 30.27 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.988 1.315 . . . . 0.0 112.739 -179.058 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.7 m -66.5 -50.24 63.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.689 1.596 . . . . 0.0 111.417 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -65.92 -45.37 82.14 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.964 -1.085 . . . . 0.0 111.973 179.813 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mp -53.25 -52.73 58.06 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.763 0.825 . . . . 0.0 112.862 170.035 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.7 p -63.6 -28.22 69.78 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 120.738 -1.226 . . . . 0.0 113.669 -179.351 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -75.81 -44.24 42.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.3 1.44 . . . . 0.0 112.783 177.312 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.6 mmt-85 -86.89 -39.21 16.02 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.586 1.154 . . . . 0.0 113.742 -176.557 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -85.06 -17.74 36.49 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.691 1.597 . . . . 0.0 111.663 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 61.66 64.14 1.07 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.978 1.711 . . . . 0.0 111.825 178.892 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 16.0 pt -132.53 162.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 127.547 2.339 . . . . 0.0 109.104 178.502 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.1 t -68.35 149.92 48.81 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.495 -0.753 . . . . 0.0 110.338 166.87 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.4 t -57.43 -34.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.987 0.915 . . . . 0.0 111.078 -177.853 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.35 -33.12 73.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 178.781 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -67.72 -35.44 78.77 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.915 0.78 . . . . 0.0 111.181 171.317 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.82 -48.78 62.7 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.796 0.726 . . . . 0.0 110.615 176.421 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -57.81 -32.11 67.24 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.564 1.546 . . . . 0.0 113.665 179.051 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.1 t -89.71 -43.18 10.88 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.024 0.829 . . . . 0.0 113.003 174.761 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -58.75 -36.95 75.18 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.76 1.164 . . . . 0.0 113.129 -177.988 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mt -48.96 -48.09 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 125.063 1.345 . . . . 0.0 111.731 173.884 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -91.66 -25.34 19.18 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 179.438 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -72.44 -31.56 65.56 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 119.397 0.999 . . . . 0.0 112.38 179.493 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t -84.39 -38.1 20.69 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.361 1.064 . . . . 0.0 113.464 177.725 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -116.22 -29.06 6.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 115.03 1.493 . . . . 0.0 115.03 -169.073 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.6 tpp85 46.87 42.63 12.38 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 128.345 2.658 . . . . 0.0 115.328 -177.868 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.5 mpt? 63.27 -35.89 0.14 Allowed 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 127.888 2.475 . . . . 0.0 115.802 -179.717 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 140.91 -66.5 0.5 Allowed Glycine 0 N--CA 1.468 0.828 0 C-N-CA 126.068 1.794 . . . . 0.0 111.329 163.729 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.2 11.44 4.2 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.652 1.581 . . . . 0.0 113.72 174.075 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.6 m -57.56 -43.5 84.55 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.011 0.924 . . . . 0.0 113.378 -175.929 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -153.11 28.09 0.52 Allowed 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.418 168.935 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -111.85 33.58 4.71 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.979 1.712 . . . . 0.0 111.967 -172.511 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -124.99 17.52 8.52 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.764 1.626 . . . . 0.0 113.21 -173.808 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -76.82 -6.17 51.23 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.107 2.163 . . . . 0.0 115.873 -175.593 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.0 t -137.17 -38.63 0.61 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.434 1.494 . . . . 0.0 112.137 177.146 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.1 mt -63.23 157.85 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.299 1.44 . . . . 0.0 109.178 167.615 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.5 -24.2 0.06 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 127.321 2.248 . . . . 0.0 116.858 -177.29 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -101.83 -25.71 13.72 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.122 1.369 . . . . 0.0 114.439 175.894 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.08 -4.68 59.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 171.387 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -88.98 149.79 23.12 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.513 1.525 . . . . 0.0 112.077 -178.961 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -142.01 34.73 1.55 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.562 1.145 . . . . 0.0 113.213 -171.287 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -81.73 144.31 31.22 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.746 -1.221 . . . . 0.0 112.46 177.651 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.1 t -130.3 -48.67 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.724 1.21 . . . . 0.0 111.703 -178.608 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 68.0 p -113.4 4.53 16.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.445 1.498 . . . . 0.0 114.205 -176.654 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 t -110.58 7.07 22.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.354 1.462 . . . . 0.0 114.507 -169.877 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.42 128.54 35.21 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.882 -1.136 . . . . 0.0 112.059 178.92 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 73.8 m -153.42 131.33 11.71 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.816 1.647 . . . . 0.0 109.616 -179.093 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.28 33.93 13.66 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.818 1.247 . . . . 0.0 114.243 -177.11 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -124.05 63.98 33.21 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.755 1.622 . . . . 0.0 113.428 178.128 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -80.03 51.05 3.74 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 124.496 3.464 . . . . 0.0 113.39 -179.469 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -105.97 77.46 1.25 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.407 1.483 . . . . 0.0 110.269 -179.794 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 92.0 mt -117.79 152.34 49.82 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 125.98 1.712 . . . . 0.0 111.911 178.552 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 C--O 1.253 1.253 0 C-N-CA 124.011 3.141 . . . . 0.0 113.388 178.19 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 112.026 -0.43 . . . . 0.0 112.026 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 8.2 t -147.56 164.48 33.31 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.383 1.473 . . . . 0.0 111.492 177.427 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -134.52 123.73 24.39 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.083 1.353 . . . . 0.0 110.626 178.992 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 65.3 mtt -124.53 109.98 13.9 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.968 1.307 . . . . 0.0 110.447 178.645 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.26 -67.75 0.69 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.955 1.302 . . . . 0.0 111.881 175.503 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.2 t 53.87 28.28 8.24 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.547 1.539 . . . . 0.0 114.901 178.445 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.64 -18.72 0.16 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -179.708 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -112.4 13.53 20.26 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.671 1.588 . . . . 0.0 112.837 -179.502 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.8 33.16 0.84 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.193 1.797 . . . . 0.0 111.335 -168.83 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.8 mp -117.39 168.08 10.68 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.263 1.825 . . . . 0.0 111.196 -179.811 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -129.56 2.7 5.02 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.169 1.388 . . . . 0.0 113.772 -175.433 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -89.26 12.42 16.08 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.408 1.483 . . . . 0.0 114.706 -175.64 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -73.05 132.56 33.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 124.677 1.191 . . . . 0.0 111.276 -174.54 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 73.4 mt -132.92 138.47 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.028 1.731 . . . . 0.0 109.327 178.044 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -135.8 167.09 21.82 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.901 1.68 . . . . 0.0 111.734 179.074 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -131.6 175.4 9.2 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.081 1.352 . . . . 0.0 112.626 -179.347 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.9 tt -65.8 -26.21 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 C-N-CA 125.27 1.428 . . . . 0.0 114.697 -177.461 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 53.89 42.27 31.77 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.305 1.442 . . . . 0.0 113.854 178.12 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -92.38 -19.36 22.16 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.12 1.368 . . . . 0.0 112.548 176.155 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 58.05 40.25 25.53 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.212 1.805 . . . . 0.0 114.535 174.412 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.71 -62.16 2.0 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.354 1.462 . . . . 0.0 114.386 -172.423 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 50.1 mt -129.46 -11.78 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.693 1.197 . . . . 0.0 113.602 -172.574 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -74.56 -15.17 60.86 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -173.274 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.3 t -81.45 -53.39 6.33 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.665 0.786 . . . . 0.0 112.492 178.147 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -68.1 -18.19 64.58 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -172.623 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.7 t -78.08 -22.91 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.152 1.381 . . . . 0.0 111.832 174.241 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.9 t -129.56 53.06 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.675 1.59 . . . . 0.0 110.933 -171.438 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.2 mt -132.07 152.17 51.35 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.588 1.555 . . . . 0.0 112.109 175.068 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -122.37 32.0 5.94 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 126.478 1.911 . . . . 0.0 112.573 -175.788 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 t30 48.97 59.18 17.45 Favored Pre-proline 0 CA--C 1.559 1.295 0 C-N-CA 126.924 2.09 . . . . 0.0 113.877 -174.476 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -77.94 78.21 3.65 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.844 3.029 . . . . 0.0 112.551 -174.0 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -129.58 -59.5 1.08 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.159 1.384 . . . . 0.0 113.477 176.142 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 p -153.96 116.47 2.61 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 124.82 1.248 . . . . 0.0 110.946 -174.356 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -86.28 159.1 9.73 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 123.367 2.711 . . . . 0.0 112.709 176.0 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 p -82.9 58.78 4.51 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.93 1.692 . . . . 0.0 112.254 174.822 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 56.75 25.61 10.43 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.647 1.979 . . . . 0.0 114.911 178.347 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.35 34.93 0.26 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.442 1.897 . . . . 0.0 113.569 -172.58 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.5 t -137.0 8.19 2.97 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -162.886 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -164.28 36.88 0.3 Allowed Glycine 0 CA--C 1.535 1.305 0 O-C-N 120.857 -1.152 . . . . 0.0 114.339 -175.555 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -93.39 24.06 4.15 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.106 1.362 . . . . 0.0 114.281 -166.409 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 56.66 82.17 0.12 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 127.875 2.47 . . . . 0.0 114.172 169.099 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 t -76.96 -79.56 0.11 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.503 1.121 . . . . 0.0 112.886 -173.39 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.47 -44.06 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.579 0.752 . . . . 0.0 111.403 -170.754 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -72.57 -28.34 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.027 0.531 . . . . 0.0 111.08 171.797 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -72.36 -49.73 32.01 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.448 1.099 . . . . 0.0 112.043 -171.167 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -65.37 -25.47 67.58 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.304 -1.497 . . . . 0.0 113.481 172.188 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -66.95 -5.54 13.12 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 167.478 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.31 -52.68 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.121 1.368 . . . . 0.0 110.043 167.153 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.8 t -79.41 -51.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.039 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.41 -32.95 74.18 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 118.982 0.81 . . . . 0.0 110.948 179.065 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.03 -36.35 74.82 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 167.773 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -40.67 70.34 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.123 -0.986 . . . . 0.0 111.776 175.72 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.2 -31.16 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 O-C-N 120.86 -1.15 . . . . 0.0 111.133 172.233 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -72.79 -17.23 61.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 171.693 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -102.49 -42.72 5.86 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.725 -1.234 . . . . 0.0 112.641 -170.665 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.98 -12.86 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -171.871 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.21 -82.54 0.34 Allowed Glycine 0 N--CA 1.469 0.852 0 C-N-CA 125.389 1.471 . . . . 0.0 112.59 167.095 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 65.5 tp -167.64 -36.27 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.263 1.825 . . . . 0.0 111.666 -179.117 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -112.29 -10.14 13.83 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.189 1.396 . . . . 0.0 114.645 -167.475 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -93.43 -15.31 25.75 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.158 0.983 . . . . 0.0 112.886 179.233 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -71.78 164.92 25.11 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.23 1.412 . . . . 0.0 113.533 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -110.13 118.63 36.9 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.637 1.175 . . . . 0.0 111.626 -179.501 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.7 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.639 1.176 . . . . 0.0 113.389 176.501 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.8 m -69.43 -41.38 76.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.313 -0.867 . . . . 0.0 111.543 173.543 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -61.3 -41.26 96.69 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.796 -1.19 . . . . 0.0 111.736 172.71 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.87 -46.32 81.89 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.675 -0.64 . . . . 0.0 111.795 168.787 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.1 p -60.59 -22.41 63.68 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.516 -1.365 . . . . 0.0 113.887 178.821 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -94.66 -43.04 8.46 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.114 1.766 . . . . 0.0 112.064 -175.492 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.4 mmt85 -79.22 -37.61 37.69 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.249 1.419 . . . . 0.0 112.835 176.872 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tp -98.88 -12.02 21.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.956 1.702 . . . . 0.0 113.544 -173.064 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.76 55.62 4.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.116 1.367 . . . . 0.0 112.643 176.218 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 10.1 pt -123.23 163.98 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 126.971 2.108 . . . . 0.0 110.731 174.913 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 58.8 m -57.88 139.44 54.2 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.711 1.204 . . . . 0.0 110.394 163.149 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -61.22 -33.82 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 O-C-N 121.116 -0.99 . . . . 0.0 111.642 -179.547 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -72.76 -31.98 65.29 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.34 -0.85 . . . . 0.0 112.946 176.281 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.27 -39.56 94.92 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.683 167.121 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.18 -49.78 72.91 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.147 0.885 . . . . 0.0 110.896 178.745 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -33.95 73.38 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -179.737 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -86.12 -40.52 15.6 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.348 0.976 . . . . 0.0 112.825 175.689 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.45 -37.39 75.33 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.974 1.31 . . . . 0.0 113.056 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.3 mt -49.05 -39.8 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.953 1.301 . . . . 0.0 111.708 171.785 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -90.25 -32.5 16.53 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.718 1.207 . . . . 0.0 113.531 178.333 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -66.19 -34.53 78.24 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.688 0.676 . . . . 0.0 111.842 -176.633 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.8 m -82.44 -39.39 22.64 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 176.487 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -156.42 79.15 0.95 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -171.724 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.5 ptt-85 -97.94 10.78 39.44 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.895 1.678 . . . . 0.0 115.016 170.506 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 85.3 mtp -64.04 -27.33 69.04 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -157.85 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 172.46 -69.01 0.11 Allowed Glycine 0 N--CA 1.469 0.859 0 CA-C-N 119.358 0.981 . . . . 0.0 111.436 161.608 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 70.9 mtp85 -113.17 -91.86 0.49 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.564 1.546 . . . . 0.0 109.173 166.868 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 62.4 p -139.92 37.2 1.96 Allowed 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.346 1.058 . . . . 0.0 113.461 -173.811 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 61.29 19.36 10.07 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.836 1.654 . . . . 0.0 113.451 -176.045 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -82.08 -13.22 57.61 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.583 1.953 . . . . 0.0 113.974 -178.483 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -74.17 14.71 0.39 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.642 1.977 . . . . 0.0 114.83 -172.097 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -80.24 -19.12 47.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.397 1.479 . . . . 0.0 112.974 -170.79 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.3 m -122.72 -39.07 2.56 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.599 1.96 . . . . 0.0 111.477 -172.834 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.4 mt -67.27 158.82 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.559 1.144 . . . . 0.0 108.415 165.131 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.6 ttmm 67.51 -10.58 0.35 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 167.644 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.3 ptt? -83.6 -26.37 30.06 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.113 0.869 . . . . 0.0 113.162 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 p90 -121.57 -10.83 8.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.844 1.258 . . . . 0.0 114.359 -175.172 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -85.04 133.52 34.24 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.64 1.176 . . . . 0.0 111.788 -176.871 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -151.48 110.58 3.9 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.079 1.351 . . . . 0.0 110.627 177.36 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 55.6 176.28 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.515 1.926 . . . . 0.0 114.798 -168.399 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 96.7 t -99.43 -19.19 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.001 1.32 . . . . 0.0 111.471 178.659 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 34.9 m 57.65 22.69 8.56 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.768 1.627 . . . . 0.0 113.716 -168.14 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 19.1 t -154.77 144.01 21.16 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.96 1.704 . . . . 0.0 110.482 173.47 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -154.65 166.43 33.4 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.452 1.501 . . . . 0.0 111.7 -176.001 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.4 t -106.68 178.52 4.54 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.86 1.264 . . . . 0.0 111.196 175.136 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.54 -31.87 71.91 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 174.396 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -148.61 150.74 34.34 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.696 1.998 . . . . 0.0 111.717 174.012 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.63 92.52 1.02 Allowed 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.658 2.906 . . . . 0.0 112.313 -176.044 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 54.39 37.63 27.99 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.511 1.924 . . . . 0.0 113.445 177.597 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.6 tt -126.14 97.27 35.16 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.405 1.482 . . . . 0.0 109.717 -171.159 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo . . . . . 0 C--O 1.253 1.252 0 C-N-CA 124.055 3.17 . . . . 0.0 113.455 -175.723 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.547 0.857 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.9 m -93.17 -73.13 0.57 Allowed 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.186 -0.946 . . . . 0.0 113.061 -168.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -162.61 -45.68 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.939 0.496 . . . . 0.0 111.432 -174.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.77 -33.89 76.61 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.641 0.777 . . . . 0.0 110.577 174.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.0 -38.75 83.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.602 1.161 . . . . 0.0 111.375 -176.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -64.89 -37.76 88.7 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 172.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -66.12 -2.42 4.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 171.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.6 mt -105.21 -53.29 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.104 1.362 . . . . 0.0 110.432 165.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.3 t -69.96 -64.06 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.059 0.845 . . . . 0.0 111.817 -173.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.62 -30.74 68.55 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 111.704 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -55.87 -36.93 68.14 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 166.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.34 -37.9 60.45 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.241 1.016 . . . . 0.0 112.311 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mm -61.5 -30.96 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 121.044 -1.035 . . . . 0.0 110.501 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 t -72.81 -17.0 61.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.91 1.284 . . . . 0.0 114.286 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -101.38 -42.66 6.2 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.601 -1.312 . . . . 0.0 112.745 -169.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.6 m -129.04 -13.31 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -169.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.88 -78.26 0.38 Allowed Glycine 0 N--CA 1.47 0.915 0 C-N-CA 125.187 1.375 . . . . 0.0 112.198 165.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tp -160.6 -45.87 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.592 1.157 . . . . 0.0 112.287 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -109.74 -8.28 14.95 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.801 1.64 . . . . 0.0 114.28 -167.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -88.72 -14.29 37.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.873 0.869 . . . . 0.0 112.852 -175.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -66.52 166.67 12.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.724 1.21 . . . . 0.0 112.082 164.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -119.09 165.16 14.5 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 122.427 1.108 . . . . 0.0 111.716 170.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.89 -26.78 59.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.551 1.14 . . . . 0.0 112.679 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -65.38 -46.06 81.56 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 112.123 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -67.37 -27.92 67.52 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.578 -1.326 . . . . 0.0 113.088 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.37 -56.92 6.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.201 1.0 . . . . 0.0 111.695 167.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.2 p -60.3 -26.68 66.7 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.565 1.146 . . . . 0.0 113.703 -177.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -70.37 -27.41 64.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.12 1.368 . . . . 0.0 113.74 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -114.08 -31.57 6.31 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.753 1.221 . . . . 0.0 113.454 -174.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.3 mt -84.69 -19.03 33.45 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.413 1.485 . . . . 0.0 112.723 173.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.53 22.38 12.09 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 126.166 1.786 . . . . 0.0 114.164 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.5 pt -73.64 164.84 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.963 1.705 . . . . 0.0 110.538 163.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 70' ' ' LYS . 15.3 t -76.34 156.8 33.01 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.512 -0.742 . . . . 0.0 110.946 166.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.09 -38.37 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.01 0.924 . . . . 0.0 111.487 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -70.08 -31.39 68.96 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.405 ' H ' HG23 ' A' ' 67' ' ' THR . 77.6 mttt -67.93 -36.67 80.55 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.076 168.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.05 -47.33 71.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.445 1.02 . . . . 0.0 111.196 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.9 mtpt -55.3 -43.38 74.77 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.536 1.534 . . . . 0.0 112.631 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -82.5 -38.23 24.14 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.8 -39.3 73.88 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.866 -1.146 . . . . 0.0 112.59 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.9 mt -48.94 -65.98 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.338 1.455 . . . . 0.0 110.453 173.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -64.91 -27.14 68.65 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 . . . . . 0 CA--C 1.54 0.584 0 CA-C-N 119.463 1.029 . . . . 0.0 112.841 -177.106 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 113.768 1.025 . . . . 0.0 113.768 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.4 4.93 0.38 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.688 1.995 . . . . 0.0 115.575 -172.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.57 -10.84 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 120.145 -1.597 . . . . 0.0 113.647 -173.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -68.03 9.25 0.32 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.12 2.168 . . . . 0.0 115.352 -176.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -92.01 -6.0 51.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 128.611 2.764 . . . . 0.0 114.234 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.2 m -141.47 -45.66 0.37 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.138 1.775 . . . . 0.0 110.489 -170.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.0 pt -64.09 168.12 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 123.689 0.796 . . . . 0.0 111.193 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? 69.06 -14.94 0.28 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 126.694 1.998 . . . . 0.0 116.241 -177.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.39 19.72 2.39 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 120.414 1.461 . . . . 0.0 114.777 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -142.94 -24.58 0.62 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.169 1.544 . . . . 0.0 115.169 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 . . . . . 0 CA--C 1.542 0.673 0 O-C-N 121.228 -0.92 . . . . 0.0 111.728 -178.654 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.908 1.077 . . . . 0.0 113.908 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.1 m -95.5 -69.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.284 . . . . 0.0 112.729 -168.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -161.72 -43.42 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -172.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -73.4 -26.05 60.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.139 0.576 . . . . 0.0 110.59 175.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 -69.73 -41.57 75.13 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.357 1.463 . . . . 0.0 110.391 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -62.47 -36.27 81.94 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.807 0.843 . . . . 0.0 112.834 168.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -65.37 -3.97 4.91 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.6 mt -109.29 -20.59 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.834 1.654 . . . . 0.0 112.393 173.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.6 t -122.89 -53.88 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 CA-C-N 119.463 1.028 . . . . 0.0 113.634 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.83 -33.34 73.97 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.616 1.098 . . . . 0.0 110.948 171.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.76 -43.88 97.42 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.874 0.87 . . . . 0.0 113.055 167.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -36.24 78.16 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.624 1.17 . . . . 0.0 112.131 -178.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.95 -24.62 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 124.883 1.273 . . . . 0.0 111.649 171.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -80.56 -16.86 53.16 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.025 1.121 . . . . 0.0 114.025 171.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -94.82 -50.65 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.668 -1.27 . . . . 0.0 112.009 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 m -123.53 -13.84 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -167.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 124.2 -75.42 0.39 Allowed Glycine 0 N--CA 1.469 0.888 0 C-N-CA 125.328 1.442 . . . . 0.0 112.913 163.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.5 tp -166.78 -40.74 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.437 1.495 . . . . 0.0 112.206 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -111.05 -5.19 14.84 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -168.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -93.48 -17.99 22.8 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.101 0.961 . . . . 0.0 112.99 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -68.29 163.82 22.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.782 1.233 . . . . 0.0 112.096 165.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -116.78 169.75 9.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 122.454 1.121 . . . . 0.0 111.645 172.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.03 -24.44 40.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.308 1.043 . . . . 0.0 112.651 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.0 m -65.26 -45.3 85.06 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.802 1.641 . . . . 0.0 112.292 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.94 -38.23 90.28 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.517 -1.365 . . . . 0.0 111.931 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.3 -51.09 71.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.5 0.72 . . . . 0.0 112.167 172.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.5 p -65.51 -31.11 71.99 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.699 0.799 . . . . 0.0 113.116 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -70.87 -41.71 71.04 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.29 1.436 . . . . 0.0 112.602 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -96.19 -35.14 11.4 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.484 1.113 . . . . 0.0 113.416 -169.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 tt -91.64 -17.29 25.75 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.14 1.776 . . . . 0.0 112.099 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 61.01 69.96 0.64 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.212 1.805 . . . . 0.0 112.712 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.9 pt -136.79 162.89 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 128.384 2.674 . . . . 0.0 109.136 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -70.15 152.53 44.19 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.382 -0.824 . . . . 0.0 111.038 167.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 t -58.92 -36.07 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.052 0.941 . . . . 0.0 111.379 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.84 -32.26 71.82 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -69.14 -35.52 76.46 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.592 -0.718 . . . . 0.0 111.117 171.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.25 -49.74 63.23 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.767 0.712 . . . . 0.0 110.568 175.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -54.11 -42.91 69.94 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.506 1.522 . . . . 0.0 112.563 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -87.02 -32.18 20.15 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -63.04 -37.77 88.51 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.505 -1.372 . . . . 0.0 112.25 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.6 mt -49.79 -44.77 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.624 1.17 . . . . 0.0 111.739 175.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -90.0 -25.2 20.98 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 . . . . . 0 CA--C 1.543 0.696 0 CA-C-N 119.848 1.204 . . . . 0.0 112.627 174.085 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.482 1.173 0 CA-C-O 121.811 0.815 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 m120 52.61 30.8 9.12 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.514 1.526 . . . . 0.0 114.739 -175.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.94 -1.01 38.31 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -68.7 13.75 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.628 1.971 . . . . 0.0 115.758 -175.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.7 pttt -91.65 -6.54 51.97 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.075 2.55 . . . . 0.0 114.318 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 90.0 m -136.93 -42.09 0.59 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.808 1.643 . . . . 0.0 111.393 -173.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.7 pt -69.42 169.43 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 123.738 0.815 . . . . 0.0 111.384 170.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 67.53 -29.17 0.15 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.199 2.199 . . . . 0.0 115.791 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.2 ptp -94.29 -34.89 12.67 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.648 1.179 . . . . 0.0 113.606 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -90.0 -25.67 20.74 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 173.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 . . . . . 0 CA--C 1.54 0.585 0 C-N-CA 124.162 0.985 . . . . 0.0 111.924 -173.375 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 C--O 1.234 0.277 0 CA-C-O 121.593 0.711 . . . . 0.0 109.444 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.9 m -114.46 -73.25 0.66 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.904 1.682 . . . . 0.0 112.855 -176.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -160.17 -32.38 0.06 Allowed 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -170.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -83.15 -27.43 30.1 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.909 0.484 . . . . 0.0 111.226 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -75.4 -42.81 52.86 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.815 1.246 . . . . 0.0 111.437 -169.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -70.8 -26.69 63.43 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.995 0.918 . . . . 0.0 112.61 174.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -66.54 -4.71 9.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 166.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.1 mt -107.09 -52.83 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.14 1.376 . . . . 0.0 110.258 166.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.82 -57.85 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.231 0.923 . . . . 0.0 111.581 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.64 67.82 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.366 0.53 . . . . 0.0 111.777 -177.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -57.85 -36.92 72.97 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 167.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -38.19 70.34 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.195 0.998 . . . . 0.0 111.852 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -58.81 -35.01 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 O-C-N 120.24 -1.538 . . . . 0.0 110.749 174.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.2 m -77.15 -4.94 47.13 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -107.26 -29.94 9.02 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.936 1.244 . . . . 0.0 113.436 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.3 p -136.21 -22.22 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 -171.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 140.05 -86.31 0.21 Allowed Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.663 1.125 . . . . 0.0 111.801 174.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.5 tp -159.54 -42.98 0.05 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.844 1.258 . . . . 0.0 112.397 174.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -117.3 2.92 12.58 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -168.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -94.95 -17.04 22.33 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.295 0.638 . . . . 0.0 112.281 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.98 161.73 18.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.122 1.369 . . . . 0.0 112.087 168.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -110.78 162.3 14.91 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.564 1.173 . . . . 0.0 111.557 168.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.81 -24.94 48.64 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.614 1.166 . . . . 0.0 112.584 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.2 m -64.02 -47.17 81.31 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.907 1.683 . . . . 0.0 111.731 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -62.59 -40.47 97.01 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.753 1.221 . . . . 0.0 113.074 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.51 -51.53 69.07 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.051 0.94 . . . . 0.0 111.278 168.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.1 m -58.76 -30.38 67.48 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.341 1.456 . . . . 0.0 113.167 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -79.4 -18.52 52.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.554 1.542 . . . . 0.0 113.511 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -110.04 -36.66 5.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.194 1.398 . . . . 0.0 113.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.24 -19.57 46.58 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.364 1.066 . . . . 0.0 112.663 171.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.12 63.12 1.48 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.175 1.39 . . . . 0.0 111.366 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.6 pt -128.34 167.28 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.544 1.938 . . . . 0.0 111.947 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.1 m -65.06 134.53 54.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.954 1.702 . . . . 0.0 109.551 165.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.77 -34.37 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 122.992 0.517 . . . . 0.0 111.742 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.2 -28.76 66.66 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 177.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -68.87 -36.95 78.72 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.272 170.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.62 -49.08 61.98 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.704 0.684 . . . . 0.0 110.437 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -53.31 -42.63 66.87 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.119 1.368 . . . . 0.0 112.594 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -87.79 -32.63 18.98 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -62.62 -38.96 92.27 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.179 -0.951 . . . . 0.0 112.228 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.6 mt -48.06 -65.6 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.013 1.325 . . . . 0.0 109.851 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.76 -28.64 67.79 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 . . . . . 0 N--CA 1.474 0.732 0 CA-C-N 120.027 1.285 . . . . 0.0 113.152 178.251 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.259 0.8 OUTLIER 46.11 26.67 0.45 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.765 2.026 . . . . 0.0 115.977 -170.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -8.28 25.42 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.719 1.208 . . . . 0.0 114.155 -175.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -72.83 15.52 0.19 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.442 1.897 . . . . 0.0 115.058 -174.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -89.32 -5.13 57.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.093 2.557 . . . . 0.0 114.726 -169.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 93.8 m -138.19 -50.47 0.58 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.206 1.802 . . . . 0.0 109.954 -171.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.2 pt -66.9 165.08 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.813 1.245 . . . . 0.0 112.279 172.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.57 -7.2 0.19 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.452 2.301 . . . . 0.0 116.018 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 47.3 mtm -93.23 -44.1 8.5 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.875 1.216 . . . . 0.0 113.518 -178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -109.85 -6.05 15.35 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 . . . . . 0 CA--C 1.542 0.654 0 C-N-CA 125.052 1.341 . . . . 0.0 112.289 177.33 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.6 mp . . . . . 0 CA--C 1.537 0.459 0 CA-C-O 121.54 0.686 . . . . 0.0 110.329 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 p -95.75 -87.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.657 1.983 . . . . 0.0 111.722 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -159.34 -36.96 0.06 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.494 1.118 . . . . 0.0 112.567 -172.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.44 -33.26 73.88 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.755 0.822 . . . . 0.0 110.471 168.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -72.23 -31.31 65.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.455 1.102 . . . . 0.0 111.404 -175.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -42.49 99.38 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.291 1.036 . . . . 0.0 113.722 165.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -60.42 -9.38 3.54 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 172.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.5 mt -99.26 -57.27 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.14 1.376 . . . . 0.0 111.153 166.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.29 -55.63 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 119.573 1.078 . . . . 0.0 112.8 -172.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.04 -32.67 74.5 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.674 -0.641 . . . . 0.0 111.056 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.76 -34.26 76.86 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -36.5 63.72 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.563 1.145 . . . . 0.0 111.703 174.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.89 -33.82 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.138 -1.601 . . . . 0.0 110.389 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.1 m -79.75 -3.54 48.01 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 170.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -101.27 -40.39 7.16 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.996 1.271 . . . . 0.0 112.501 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 p -132.98 -22.8 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 -169.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 142.98 -84.9 0.19 Allowed Glycine 0 N--CA 1.469 0.883 0 C-N-CA 124.559 1.076 . . . . 0.0 111.517 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -165.6 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 111.302 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -104.85 -9.31 18.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.591 1.556 . . . . 0.0 114.771 -166.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -92.17 -16.95 25.57 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.66 0.664 . . . . 0.0 112.713 -174.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.93 161.21 18.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.334 1.454 . . . . 0.0 114.521 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.1 t-20 -100.95 123.4 45.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.011 1.324 . . . . 0.0 110.948 -177.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.55 -28.84 70.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.673 1.189 . . . . 0.0 113.022 177.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.2 m -68.33 -42.63 79.03 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.555 0.742 . . . . 0.0 111.671 176.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -62.2 -37.83 86.82 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.37 -0.831 . . . . 0.0 112.382 175.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.38 -47.37 84.45 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.692 -0.63 . . . . 0.0 111.868 168.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -60.28 -27.16 67.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -76.0 -26.65 56.93 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.252 1.821 . . . . 0.0 112.941 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -105.18 -37.62 6.84 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.367 1.467 . . . . 0.0 112.885 -177.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -17.14 53.31 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.417 1.087 . . . . 0.0 112.453 173.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 59.49 60.23 2.35 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.205 1.402 . . . . 0.0 112.079 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.6 pt -128.76 175.76 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 127.971 2.509 . . . . 0.0 109.645 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.498 HG23 ' H ' ' A' ' 70' ' ' LYS . 10.1 t -77.09 148.64 35.97 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.407 -0.808 . . . . 0.0 110.675 163.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.93 -29.78 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.37 1.068 . . . . 0.0 111.153 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -70.63 -29.65 66.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.498 ' H ' HG23 ' A' ' 67' ' ' THR . 91.0 mttt -73.87 -37.13 64.84 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.818 -0.61 . . . . 0.0 111.183 167.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.88 -47.07 76.06 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.425 0.557 . . . . 0.0 111.006 -177.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 53.8 pttt -70.6 -20.49 62.76 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -176.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -93.41 -39.27 11.01 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.085 0.857 . . . . 0.0 112.336 171.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.69 -42.57 75.39 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.139 -0.976 . . . . 0.0 112.292 177.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mt -47.39 -63.98 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.699 1.2 . . . . 0.0 110.455 175.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.3 pttt -73.37 -32.52 64.55 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m120 . . . . . 0 CA--C 1.537 0.462 0 CA-C-N 118.801 0.728 . . . . 0.0 112.295 -177.364 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.68 31.91 13.62 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 114.3 -174.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.81 -9.26 23.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.778 1.231 . . . . 0.0 113.977 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -75.79 15.88 0.46 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.482 1.913 . . . . 0.0 115.05 -175.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -84.06 9.68 11.92 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.944 2.498 . . . . 0.0 115.165 -170.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -145.62 -46.5 0.21 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.397 1.879 . . . . 0.0 110.054 -168.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.1 mt -74.59 161.83 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.131 1.772 . . . . 0.0 109.289 175.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.72 -9.52 0.18 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 117.086 2.254 . . . . 0.0 117.086 177.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 36.8 mtm -93.12 -32.24 14.51 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -175.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -100.61 -10.79 20.61 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.255 1.022 . . . . 0.0 113.631 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 . . . . . 0 CA--C 1.552 1.035 0 C-N-CA 126.092 1.757 . . . . 0.0 113.185 -171.086 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.0 mp . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.4 t -82.01 -73.06 0.41 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.914 0.886 . . . . 0.0 111.899 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -162.87 -36.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.053 0.541 . . . . 0.0 112.306 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -75.25 -33.4 61.29 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.733 0.413 . . . . 0.0 111.466 171.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -69.35 -42.12 75.71 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.427 -0.795 . . . . 0.0 112.264 -171.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 ptpt -70.44 -25.58 63.26 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.2 -0.938 . . . . 0.0 113.068 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -71.89 2.48 5.46 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 166.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.9 mt -110.78 -43.22 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.572 1.549 . . . . 0.0 110.895 168.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.8 t -79.8 -63.89 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 119.176 0.898 . . . . 0.0 112.447 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.06 -28.44 68.2 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.329 -0.857 . . . . 0.0 112.456 -175.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.71 -17.39 64.07 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 168.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -34.21 17.67 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.636 1.174 . . . . 0.0 111.093 170.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.5 mm -61.69 -21.76 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 120.537 -1.352 . . . . 0.0 112.451 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.4 p -90.3 -4.83 56.88 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 171.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -93.54 -56.81 2.79 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.993 1.269 . . . . 0.0 112.517 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.0 m -117.61 -37.85 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -166.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.45 -90.77 0.13 Allowed Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.08 1.324 . . . . 0.0 112.057 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.4 tp -167.35 -47.75 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.566 1.547 . . . . 0.0 111.52 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -96.03 19.36 11.74 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.626 1.57 . . . . 0.0 113.163 -168.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -149.54 -5.02 0.38 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.808 2.043 . . . . 0.0 113.268 -159.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.91 161.66 24.26 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.086 1.354 . . . . 0.0 112.396 172.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -98.62 113.99 26.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.376 0.608 . . . . 0.0 111.327 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.64 -23.23 65.92 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.379 1.472 . . . . 0.0 113.737 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.7 m -65.74 -38.23 88.55 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.132 0.973 . . . . 0.0 112.104 174.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -69.48 -35.18 75.33 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 120.599 -1.313 . . . . 0.0 112.146 177.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.57 -54.62 43.23 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.404 0.682 . . . . 0.0 110.82 167.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.7 p -66.58 -28.43 68.51 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -61.2 -52.31 65.35 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.93 1.692 . . . . 0.0 112.473 170.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.4 mtp-105 -87.1 -35.82 18.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -172.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.72 -18.85 46.5 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.464 1.506 . . . . 0.0 111.402 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.75 65.21 0.84 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.303 1.841 . . . . 0.0 112.008 177.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.1 pt -131.24 174.01 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 127.175 2.19 . . . . 0.0 110.566 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.0 m -69.38 139.11 54.13 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.083 1.353 . . . . 0.0 109.247 165.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.2 t -57.36 -39.14 66.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.301 0.64 . . . . 0.0 111.575 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -68.53 -27.94 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.442 0.905 . . . . 0.0 113.442 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.03 -35.14 76.28 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 111.286 173.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.07 64.07 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.854 0.752 . . . . 0.0 110.469 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.23 -37.32 69.55 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.528 1.131 . . . . 0.0 112.934 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.9 t -86.87 -35.96 18.72 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -63.35 -35.42 80.33 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.041 -1.037 . . . . 0.0 112.916 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mt -48.02 -44.37 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.99 1.316 . . . . 0.0 111.442 173.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -86.42 -34.86 20.02 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 . . . . . 0 CA--C 1.543 0.702 0 CA-C-N 118.299 0.5 . . . . 0.0 112.082 -178.348 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.0 p . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 62.24 38.54 13.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 125.488 1.515 . . . . 0.0 113.18 -171.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -93.08 -2.78 55.19 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 175.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -72.46 16.25 0.15 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.407 1.883 . . . . 0.0 115.291 -175.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.0 pttp -83.84 -6.08 59.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.004 2.122 . . . . 0.0 113.655 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 61.9 m -138.24 -47.79 0.53 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.949 2.099 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.0 mt -76.83 156.0 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.776 1.23 . . . . 0.0 109.684 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 67.82 -4.43 0.98 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 127.415 2.286 . . . . 0.0 116.698 178.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 34.5 mtm -85.99 -49.08 8.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.704 1.138 . . . . 0.0 112.359 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -88.05 -19.29 27.31 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.574 1.15 . . . . 0.0 113.287 -174.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 . . . . . 0 CA--C 1.544 0.746 0 C-N-CA 126.18 1.792 . . . . 0.0 113.321 -172.283 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 mp . . . . . 0 CA--C 1.536 0.432 0 CA-C-O 120.967 0.413 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -92.3 -81.94 0.33 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.998 1.319 . . . . 0.0 111.552 173.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -159.07 -29.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.66 -170.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -82.4 -31.63 29.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.204 0.602 . . . . 0.0 111.5 170.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.86 -41.66 82.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.232 -0.918 . . . . 0.0 112.288 -175.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -69.46 -26.4 64.56 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.882 -1.136 . . . . 0.0 113.116 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -69.03 -3.6 13.71 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 166.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.1 mt -100.88 -54.56 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.788 1.235 . . . . 0.0 109.82 164.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.71 -56.7 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 119.398 0.999 . . . . 0.0 112.797 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.08 -30.45 70.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.577 -0.702 . . . . 0.0 111.338 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.55 -46.1 91.45 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 167.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -36.49 82.74 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.519 1.054 . . . . 0.0 111.826 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -24.81 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 O-C-N 120.7 -1.25 . . . . 0.0 112.009 172.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -79.9 -16.2 55.82 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 171.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.96 -50.89 5.11 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.695 -1.253 . . . . 0.0 112.002 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.7 m -124.49 -12.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -167.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 122.62 -74.82 0.37 Allowed Glycine 0 N--CA 1.468 0.831 0 C-N-CA 125.546 1.546 . . . . 0.0 112.602 164.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.5 tp -166.84 -41.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.332 1.453 . . . . 0.0 112.244 175.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.0 m-80 -108.81 -6.25 15.91 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -166.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -93.74 -19.45 21.06 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.156 0.982 . . . . 0.0 113.09 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -65.93 162.48 19.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.861 1.264 . . . . 0.0 112.21 166.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -112.23 167.1 10.69 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.541 1.162 . . . . 0.0 111.876 172.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.54 -21.55 35.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.656 1.182 . . . . 0.0 112.81 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.4 m -63.88 -48.68 75.71 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.489 1.516 . . . . 0.0 111.394 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -65.12 -43.04 93.27 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.088 -1.007 . . . . 0.0 111.956 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -56.96 -54.53 45.65 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.784 0.834 . . . . 0.0 112.067 171.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -63.61 -21.83 66.57 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt -79.21 -44.8 21.12 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.837 1.255 . . . . 0.0 112.094 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -80.34 -36.55 34.02 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.65 1.18 . . . . 0.0 113.401 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 mt -87.64 -20.83 25.79 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.385 1.474 . . . . 0.0 113.167 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.85 61.25 1.96 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.27 1.428 . . . . 0.0 111.94 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -123.56 169.31 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 127.052 2.141 . . . . 0.0 110.557 174.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -65.57 138.53 58.1 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.832 1.253 . . . . 0.0 109.605 164.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 13.3 t -57.54 -38.06 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 123.407 0.683 . . . . 0.0 111.496 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -72.05 -25.93 61.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.82 -36.53 75.68 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.568 -0.729 . . . . 0.0 110.676 169.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.13 71.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.852 0.751 . . . . 0.0 110.904 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -53.59 -41.01 66.14 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.292 1.437 . . . . 0.0 112.705 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -87.63 -33.34 18.86 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -63.29 -36.16 82.74 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.809 -1.182 . . . . 0.0 112.68 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.85 -45.38 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.847 1.259 . . . . 0.0 111.448 174.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -90.74 -27.7 18.76 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 . . . . . 0 CA--C 1.543 0.704 0 CA-C-N 120.158 1.345 . . . . 0.0 112.805 176.898 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.8 p . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 122.74 1.257 . . . . 0.0 114.349 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.45 -13.82 61.95 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.756 2.022 . . . . 0.0 112.496 -173.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -60.35 -19.9 57.37 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.764 2.826 . . . . 0.0 112.874 174.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.79 18.93 0.15 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.294 1.837 . . . . 0.0 115.443 -176.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -81.78 -4.35 56.15 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -142.87 -49.09 0.34 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.108 1.763 . . . . 0.0 110.256 -167.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.9 pt -70.89 161.15 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.694 1.198 . . . . 0.0 112.22 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.29 -9.02 0.13 Allowed 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 127.202 2.201 . . . . 0.0 116.389 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 39.6 mtm -89.04 -36.44 15.79 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.871 1.214 . . . . 0.0 113.462 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -86.83 -19.11 29.44 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 CA--C 1.541 0.624 0 C-N-CA 124.581 1.153 . . . . 0.0 111.512 176.611 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 CA--C 1.536 0.406 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -116.37 -72.54 0.69 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.439 1.896 . . . . 0.0 111.84 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.84 -45.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.975 0.51 . . . . 0.0 111.158 -172.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -63.48 -30.65 71.74 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.467 0.707 . . . . 0.0 110.941 174.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -69.14 -35.4 76.32 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 111.842 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -70.54 -35.66 73.26 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.394 -0.816 . . . . 0.0 112.167 170.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -62.61 -7.43 4.74 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 170.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.3 mt -102.98 -55.43 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 125.581 1.552 . . . . 0.0 110.609 170.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 39.3 t -83.9 -55.2 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -172.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.02 -30.04 70.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.874 0.761 . . . . 0.0 112.189 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.17 -38.36 79.59 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.216 0.606 . . . . 0.0 112.431 167.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.82 -36.82 78.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.263 1.025 . . . . 0.0 111.694 173.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.79 -26.66 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 120.851 -1.156 . . . . 0.0 111.555 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -81.0 -8.73 59.84 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 171.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -98.78 -57.84 2.09 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.477 1.489 . . . . 0.0 112.33 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.6 m -118.0 -18.32 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 -164.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.98 -92.27 0.27 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.73 1.634 . . . . 0.0 110.468 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -166.82 -29.41 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.197 1.799 . . . . 0.0 112.976 173.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -99.36 -14.58 19.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.399 1.48 . . . . 0.0 114.133 -176.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -93.87 -14.99 25.47 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.216 1.006 . . . . 0.0 113.413 -175.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.85 166.29 21.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.639 1.576 . . . . 0.0 114.0 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -108.88 115.63 30.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.621 1.169 . . . . 0.0 111.189 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.36 63.27 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.002 1.321 . . . . 0.0 113.775 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.9 m -65.89 -40.01 91.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.102 0.961 . . . . 0.0 111.939 175.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -66.33 -37.41 85.31 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.437 -1.414 . . . . 0.0 112.244 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.68 -50.12 73.78 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.169 0.587 . . . . 0.0 110.817 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.6 p -69.9 -29.66 66.9 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -66.19 -36.59 83.49 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.321 1.449 . . . . 0.0 112.974 173.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.4 mmt-85 -92.83 -39.29 11.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.672 1.189 . . . . 0.0 113.535 -176.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 tt -80.82 -20.2 42.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.628 1.171 . . . . 0.0 111.976 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.24 65.79 0.49 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.67 1.988 . . . . 0.0 112.403 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.6 pt -132.65 -178.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 128.118 2.567 . . . . 0.0 109.295 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -81.53 156.13 25.41 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.361 -0.837 . . . . 0.0 111.052 165.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -58.51 -39.37 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.163 0.985 . . . . 0.0 111.241 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -69.76 -26.47 64.32 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.83 -40.42 87.98 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.701 0.682 . . . . 0.0 111.186 168.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.82 -48.68 65.56 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.349 0.522 . . . . 0.0 109.903 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -53.57 -39.06 64.48 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.433 1.493 . . . . 0.0 112.707 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -84.65 -41.77 16.0 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.851 0.75 . . . . 0.0 112.509 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.59 -35.98 77.44 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.14 -0.975 . . . . 0.0 113.129 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.2 mt -47.62 -51.65 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.297 1.439 . . . . 0.0 111.342 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -85.35 -33.46 22.04 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 . . . . . 0 CA--C 1.544 0.743 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -176.522 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.481 1.081 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 57.11 5.61 0.27 Allowed 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 -174.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -3.06 50.75 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 119.749 -1.844 . . . . 0.0 114.186 -170.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -70.06 12.76 0.19 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.934 2.094 . . . . 0.0 115.077 -176.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -86.04 -15.42 41.38 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.873 1.669 . . . . 0.0 113.883 -173.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.5 m -123.37 -42.88 2.21 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.167 1.787 . . . . 0.0 110.857 -171.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -72.33 166.61 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 124.612 1.165 . . . . 0.0 108.783 167.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? 67.58 -8.31 0.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.996 2.119 . . . . 0.0 116.138 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.26 -10.4 8.96 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -114.9 -14.91 11.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -161.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 . . . . . 0 N--CA 1.477 0.903 0 C-N-CA 124.963 1.305 . . . . 0.0 114.116 179.411 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 CA--C 1.534 0.344 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -105.21 -70.82 0.76 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 110.995 168.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -163.82 -43.34 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.715 0.806 . . . . 0.0 110.715 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.8 10.82 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.278 1.431 . . . . 0.0 112.799 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -111.89 -46.95 3.18 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.793 1.237 . . . . 0.0 112.482 175.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -67.44 -25.67 66.02 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.746 -1.221 . . . . 0.0 112.641 175.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -65.88 -10.63 40.16 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.491 1.517 . . . . 0.0 113.713 168.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.43 -57.01 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 125.158 1.383 . . . . 0.0 110.226 165.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.2 t -71.27 -49.45 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.064 1.302 . . . . 0.0 112.955 -168.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.1 87.33 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.757 0.708 . . . . 0.0 110.98 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.89 -38.54 82.56 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.21 -34.57 63.76 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.928 0.891 . . . . 0.0 112.346 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.99 -36.04 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.227 -0.921 . . . . 0.0 111.239 170.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.9 m -73.42 -13.41 61.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 172.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -100.8 -40.41 7.33 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.767 1.167 . . . . 0.0 112.323 -172.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.8 m -134.62 -22.47 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -175.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 93.71 135.62 7.66 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 119.619 1.099 . . . . 0.0 111.772 -172.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.15 -25.02 1.3 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 128.167 2.587 . . . . 0.0 114.869 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -89.05 -14.86 35.42 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.158 1.383 . . . . 0.0 113.66 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -114.66 -21.53 10.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.863 1.265 . . . . 0.0 113.47 -172.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.2 169.99 11.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.626 1.171 . . . . 0.0 112.738 171.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p30 -113.25 168.95 9.3 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.036 0.922 . . . . 0.0 111.387 169.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.03 -23.45 35.9 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.217 1.007 . . . . 0.0 112.702 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 m -61.53 -44.62 96.72 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.941 1.696 . . . . 0.0 112.254 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -65.7 -34.04 77.28 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.652 -1.28 . . . . 0.0 112.763 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.54 -51.43 50.89 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.514 0.597 . . . . 0.0 111.483 172.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.4 p -61.98 -18.15 59.44 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -84.19 -32.28 24.66 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.82 1.248 . . . . 0.0 112.826 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -102.69 -36.08 8.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.016 1.326 . . . . 0.0 113.205 -175.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.16 -16.2 41.2 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.679 1.192 . . . . 0.0 113.197 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.25 47.63 13.87 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-O 122.78 1.276 . . . . 0.0 111.628 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.7 pt -110.82 160.0 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 127.969 2.507 . . . . 0.0 109.795 175.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.2 t -68.25 152.04 46.05 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.496 -0.753 . . . . 0.0 110.809 167.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.8 t -58.09 -36.67 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.001 0.92 . . . . 0.0 111.287 -176.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -69.53 -32.25 70.96 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -67.91 -38.87 83.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.787 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.27 -48.79 71.97 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.628 0.649 . . . . 0.0 110.471 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -54.57 -42.34 70.89 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.469 1.507 . . . . 0.0 112.746 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -87.43 -33.37 19.1 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -64.39 -37.33 87.12 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.802 0.841 . . . . 0.0 112.395 177.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.2 mt -48.03 -50.68 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.49 1.116 . . . . 0.0 111.02 174.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -84.64 -30.31 25.0 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 . . . . . 0 CA--C 1.543 0.68 0 CA-C-N 119.769 1.168 . . . . 0.0 113.391 179.907 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.482 1.135 0 CA-C-O 121.934 0.873 . . . . 0.0 112.825 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 54.8 31.19 15.08 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.788 2.035 . . . . 0.0 113.955 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -90.65 -10.82 41.8 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -175.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -76.01 9.83 2.23 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.186 1.794 . . . . 0.0 115.611 -162.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -11.05 58.77 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.421 1.888 . . . . 0.0 114.461 -177.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 89.5 m -138.15 -41.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.59 1.556 . . . . 0.0 111.012 -162.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.7 pt -68.03 171.57 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.786 0.834 . . . . 0.0 111.349 171.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? 66.76 -20.18 0.11 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 127.033 2.133 . . . . 0.0 116.054 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 -9.71 11.18 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -111.7 -28.81 7.95 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 -166.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 . . . . . 0 CA--C 1.543 0.676 0 C-N-CA 124.492 1.117 . . . . 0.0 112.315 177.852 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp . . . . . 0 CA--C 1.535 0.366 0 CA-C-O 121.502 0.668 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -119.24 -68.12 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.428 1.891 . . . . 0.0 112.415 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -164.56 -39.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -173.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -67.84 -29.94 69.2 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.437 0.695 . . . . 0.0 110.714 171.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -75.2 -35.49 61.5 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.153 0.981 . . . . 0.0 111.909 -173.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -66.58 -36.64 83.11 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.244 -0.91 . . . . 0.0 112.874 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.49 -4.68 2.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 170.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mt -109.78 -52.6 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 125.415 1.486 . . . . 0.0 110.816 168.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.5 t -68.06 -63.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.738 0.815 . . . . 0.0 111.563 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.88 69.39 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.098 0.559 . . . . 0.0 111.583 -175.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -58.03 -37.23 73.95 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.62 -35.52 62.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.884 1.274 . . . . 0.0 111.789 173.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.17 -34.54 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.069 -1.644 . . . . 0.0 110.566 173.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -78.7 -1.97 37.04 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 169.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -101.28 -45.5 5.32 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 120.013 1.279 . . . . 0.0 112.55 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.95 -12.37 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.4 -78.51 0.36 Allowed Glycine 0 N--CA 1.469 0.845 0 C-N-CA 125.161 1.363 . . . . 0.0 111.971 166.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.5 tt -161.19 -48.92 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.762 1.225 . . . . 0.0 112.066 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -95.71 -17.93 20.88 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.202 1.801 . . . . 0.0 114.391 -171.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -85.73 -14.29 45.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -167.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 170.77 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.656 1.583 . . . . 0.0 112.761 168.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -124.42 166.22 16.36 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.558 1.17 . . . . 0.0 112.659 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.54 -28.62 56.37 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.134 1.374 . . . . 0.0 112.551 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -64.44 -46.05 84.86 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.388 1.475 . . . . 0.0 112.039 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -61.44 -50.87 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.628 0.771 . . . . 0.0 111.597 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.0 mt -54.51 -42.32 70.68 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.563 -0.711 . . . . 0.0 111.63 176.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 m -60.84 -28.65 68.99 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.209 1.403 . . . . 0.0 113.876 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -85.92 -31.44 22.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.237 1.415 . . . . 0.0 112.588 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -96.68 -33.54 11.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.448 1.099 . . . . 0.0 113.009 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.9 mt -89.8 -17.1 28.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.925 1.29 . . . . 0.0 113.479 175.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.54 54.33 3.08 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 122.843 1.306 . . . . 0.0 112.684 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.2 pt -119.26 164.96 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 126.923 2.089 . . . . 0.0 110.379 175.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.42 HG23 ' H ' ' A' ' 70' ' ' LYS . 8.9 t -74.28 147.99 41.84 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 121.796 -0.565 . . . . 0.0 110.866 166.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.3 t -54.49 -30.66 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.134 1.374 . . . . 0.0 111.08 176.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.55 -27.04 61.13 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.42 ' H ' HG23 ' A' ' 67' ' ' THR . 4.1 mtmp? -81.33 -32.71 32.89 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.361 0.982 . . . . 0.0 111.15 167.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.42 74.51 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.969 0.804 . . . . 0.0 111.462 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -68.16 -25.96 65.52 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -94.4 -33.39 13.17 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -57.56 -44.22 85.11 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.214 -0.929 . . . . 0.0 111.852 175.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.8 mt -47.3 -60.72 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.989 1.316 . . . . 0.0 110.631 176.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -77.21 -18.65 57.55 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -175.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 . . . . . 0 N--CA 1.471 0.621 0 CA-C-N 119.583 1.083 . . . . 0.0 112.648 174.929 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.7 p . . . . . 0 N--CA 1.482 1.156 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.9 m120 60.94 16.65 7.13 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -76.76 -8.71 57.81 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.643 -1.286 . . . . 0.0 114.196 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -70.38 13.45 0.17 Allowed 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 125.815 1.646 . . . . 0.0 114.262 176.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -85.67 -12.54 51.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.601 2.36 . . . . 0.0 112.878 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 36.3 m -130.42 -42.6 1.18 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.204 1.802 . . . . 0.0 111.269 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.2 mt -71.46 156.45 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.312 1.045 . . . . 0.0 108.34 166.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 65.01 -6.1 0.36 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 117.368 2.358 . . . . 0.0 117.368 171.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -83.6 -28.91 28.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.486 1.039 . . . . 0.0 113.391 175.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -108.62 -14.87 14.54 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.901 1.281 . . . . 0.0 113.43 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 . . . . . 0 CA--C 1.542 0.667 0 C-N-CA 126.239 1.815 . . . . 0.0 112.501 -174.476 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.473 0.719 0 CA-C-O 122.163 0.982 . . . . 0.0 113.218 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.1 m -147.58 90.17 1.83 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.163 2.185 . . . . 0.0 111.322 -171.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.84 5.74 3.59 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 161.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -128.49 -38.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.719 1.207 . . . . 0.0 111.05 172.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -74.74 -32.95 62.26 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.149 1.38 . . . . 0.0 111.942 -173.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -67.9 -36.41 80.16 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.299 -0.875 . . . . 0.0 112.241 171.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -63.29 -4.98 2.92 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 170.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.2 mt -109.54 -15.8 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.052 1.741 . . . . 0.0 112.563 174.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.0 t -128.78 -55.86 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 119.316 0.962 . . . . 0.0 112.904 -172.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.73 -40.67 95.9 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.643 1.11 . . . . 0.0 111.124 173.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -66.49 -27.53 67.86 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 172.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.11 -38.48 56.86 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.303 1.041 . . . . 0.0 111.682 175.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.64 -34.28 54.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.826 -1.171 . . . . 0.0 110.642 169.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -72.44 -10.84 60.29 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -106.78 -42.35 4.97 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.423 1.465 . . . . 0.0 112.894 -173.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -127.18 -14.88 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -173.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.07 -79.67 0.35 Allowed Glycine 0 N--CA 1.468 0.768 0 C-N-CA 125.373 1.463 . . . . 0.0 112.044 165.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tt -164.05 -46.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.945 1.298 . . . . 0.0 112.042 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -98.79 -17.2 18.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.316 1.846 . . . . 0.0 114.531 -172.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -87.15 -14.5 41.07 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -68.78 165.98 18.51 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.342 1.457 . . . . 0.0 112.085 166.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -119.81 169.62 9.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.284 1.04 . . . . 0.0 111.831 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.66 -23.18 42.68 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.388 1.075 . . . . 0.0 112.824 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.3 m -67.41 -46.25 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.827 1.651 . . . . 0.0 112.15 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.16 -29.87 69.68 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 120.453 -1.405 . . . . 0.0 112.829 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.83 -54.56 18.1 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.429 1.091 . . . . 0.0 112.031 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.3 p -60.63 -30.17 69.7 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.732 0.813 . . . . 0.0 112.989 -177.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -69.34 -45.12 70.2 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.374 1.47 . . . . 0.0 113.388 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 75.8 mtt85 -95.6 -36.74 11.14 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.23 -15.65 46.09 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.431 1.493 . . . . 0.0 111.18 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.99 60.2 2.2 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.229 1.812 . . . . 0.0 112.155 175.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.0 pt -128.88 162.15 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 128.209 2.603 . . . . 0.0 109.408 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.418 HG23 ' H ' ' A' ' 70' ' ' LYS . 12.8 t -68.29 151.5 46.82 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.499 -0.75 . . . . 0.0 110.666 167.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -58.7 -36.03 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.84 0.856 . . . . 0.0 111.007 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.43 -32.59 73.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 177.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.418 ' H ' HG23 ' A' ' 67' ' ' THR . 58.6 mttt -66.4 -37.52 85.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.6 -0.714 . . . . 0.0 111.064 170.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.83 62.19 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.791 0.723 . . . . 0.0 110.28 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -56.52 -35.28 67.9 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.845 1.658 . . . . 0.0 113.403 178.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -86.95 -43.03 12.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.933 0.788 . . . . 0.0 112.634 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.43 -37.58 78.45 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.735 1.152 . . . . 0.0 113.142 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -47.49 -57.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.544 1.137 . . . . 0.0 110.882 173.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.2 pttm -78.88 -35.13 44.15 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 . . . . . 0 CA--C 1.543 0.69 0 CA-C-N 119.149 0.886 . . . . 0.0 112.739 -178.157 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 55.98 9.93 0.52 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.71 2.004 . . . . 0.0 115.728 -172.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.36 10.05 37.68 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.316 1.446 . . . . 0.0 114.246 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.6 p90 -68.75 18.18 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 127.036 2.134 . . . . 0.0 114.717 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -76.97 -25.96 53.39 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.32 2.248 . . . . 0.0 111.474 -177.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 86.1 m -131.11 -42.98 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.892 2.077 . . . . 0.0 111.367 -169.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 mt -76.22 159.21 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.54 1.136 . . . . 0.0 108.859 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 66.93 -22.81 0.11 Allowed 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 127.559 2.344 . . . . 0.0 116.227 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -23.48 26.52 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.798 1.181 . . . . 0.0 114.079 -168.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -107.87 -11.09 15.42 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -171.246 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--O 1.233 0.23 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -129.17 -69.12 0.71 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.934 0.893 . . . . 0.0 112.551 -176.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -156.35 -20.35 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -166.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -93.04 -31.79 14.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.328 0.651 . . . . 0.0 111.465 168.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -79.25 -43.34 23.94 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.804 . . . . 0.0 112.626 -166.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -69.64 -23.47 63.49 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.26 -0.9 . . . . 0.0 112.533 174.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -68.61 -3.7 12.78 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 164.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -106.01 -50.37 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.173 1.389 . . . . 0.0 109.856 165.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 47.5 t -66.69 -62.2 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.417 1.008 . . . . 0.0 111.558 -174.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.75 64.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.907 -0.496 . . . . 0.0 111.944 -175.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -57.15 -39.57 75.49 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 167.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.68 -34.39 64.87 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.221 1.008 . . . . 0.0 112.075 175.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -62.52 -34.26 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 O-C-N 120.656 -1.278 . . . . 0.0 110.081 173.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.4 t -75.32 -10.33 59.37 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 170.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -99.22 -43.9 6.45 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.342 -1.474 . . . . 0.0 112.534 -173.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.4 m -132.51 -11.81 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -171.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.02 -77.73 0.39 Allowed Glycine 0 N--CA 1.471 0.993 0 C-N-CA 125.031 1.3 . . . . 0.0 112.478 165.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 tp -161.88 -44.0 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.763 1.225 . . . . 0.0 112.159 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -109.6 -8.35 14.99 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.299 1.439 . . . . 0.0 114.25 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -89.08 -14.24 36.78 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 112.838 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.36 166.35 18.8 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.065 1.346 . . . . 0.0 112.339 167.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -124.04 165.5 17.37 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.585 1.183 . . . . 0.0 112.33 173.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.55 60.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.592 1.157 . . . . 0.0 112.932 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -65.11 -44.96 87.05 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.454 1.501 . . . . 0.0 111.942 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.27 -32.0 73.42 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.566 -1.334 . . . . 0.0 112.76 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tp -72.51 -47.89 44.88 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.302 0.641 . . . . 0.0 111.555 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.5 p -63.46 -28.68 70.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.443 1.097 . . . . 0.0 113.077 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.71 -37.3 76.5 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.844 1.258 . . . . 0.0 113.34 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -104.4 -33.21 8.69 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -175.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 tt -84.89 -17.69 37.11 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 176.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.89 69.51 0.67 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.43 1.892 . . . . 0.0 112.373 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -134.45 168.9 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.019 2.127 . . . . 0.0 111.254 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.6 m -69.7 136.92 51.6 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.893 1.277 . . . . 0.0 110.042 166.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.2 t -58.09 -35.48 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.169 0.988 . . . . 0.0 111.832 -178.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -69.95 -26.59 64.19 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -78.75 -33.36 46.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.891 169.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -49.47 68.66 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.749 0.704 . . . . 0.0 110.716 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -67.54 -21.04 65.48 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 t -96.33 -35.13 11.32 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.939 0.791 . . . . 0.0 113.047 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -57.72 -43.32 85.2 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.874 0.87 . . . . 0.0 111.935 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.2 mt -46.39 -62.51 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.076 1.35 . . . . 0.0 110.653 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -81.03 5.34 16.76 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 . . . . . 0 CA--C 1.543 0.681 0 C-N-CA 124.275 1.03 . . . . 0.0 112.766 169.757 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 114.014 1.116 . . . . 0.0 114.014 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.277 0.7 OUTLIER 47.86 25.05 0.67 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.47 1.908 . . . . 0.0 115.324 -170.665 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.65 -3.56 49.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.615 1.166 . . . . 0.0 113.71 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -75.02 18.77 0.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.839 2.056 . . . . 0.0 114.333 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -68.97 -16.76 63.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.543 2.337 . . . . 0.0 114.003 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 t -144.11 -19.26 0.57 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.582 1.553 . . . . 0.0 113.19 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.98 156.54 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 126.029 1.732 . . . . 0.0 108.896 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.3 -0.38 0.67 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -171.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.5 ptm -125.1 -3.04 7.6 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.298 1.439 . . . . 0.0 114.5 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -129.28 -19.68 3.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -163.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 . . . . . 0 CA--C 1.542 0.643 0 C-N-CA 124.829 1.252 . . . . 0.0 112.371 -179.01 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 CA--C 1.535 0.39 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.1 t -140.6 -62.79 0.49 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.769 1.228 . . . . 0.0 114.084 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -161.11 -26.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -165.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -105.11 12.26 32.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.658 1.583 . . . . 0.0 111.351 176.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -118.7 -48.98 2.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.193 0.997 . . . . 0.0 112.354 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -67.24 -22.71 65.68 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.512 -1.367 . . . . 0.0 112.891 171.381 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -66.47 -11.11 50.59 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 169.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.2 mp -95.01 -60.73 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.54 1.536 . . . . 0.0 108.145 169.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.5 t -77.32 -50.77 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.32 65.09 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.563 -0.711 . . . . 0.0 111.924 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -72.97 -35.29 66.87 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.163 1.385 . . . . 0.0 113.313 168.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.35 -36.98 84.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.822 -1.174 . . . . 0.0 111.58 174.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.18 -21.62 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 O-C-N 121.103 -0.998 . . . . 0.0 111.596 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.0 m -89.68 -5.32 57.17 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.746 1.219 . . . . 0.0 114.121 169.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -111.62 -33.21 6.42 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.958 1.254 . . . . 0.0 113.243 -173.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -138.11 -14.16 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 114.911 1.448 . . . . 0.0 114.911 -177.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.86 -80.82 0.34 Allowed Glycine 0 N--CA 1.469 0.885 0 C-N-CA 125.135 1.35 . . . . 0.0 112.538 167.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 57.3 tp -168.88 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.153 1.781 . . . . 0.0 111.559 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -116.49 -5.07 11.72 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -165.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.4 m-80 -99.41 -18.74 17.33 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 118.603 0.638 . . . . 0.0 112.671 -178.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pp -65.94 158.01 29.21 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.169 1.388 . . . . 0.0 112.227 170.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -113.02 171.17 7.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.338 1.066 . . . . 0.0 111.661 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.29 -19.88 30.88 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.609 1.164 . . . . 0.0 112.798 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -67.59 -45.92 74.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.031 1.732 . . . . 0.0 112.257 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -65.83 -37.91 87.51 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.698 -1.251 . . . . 0.0 111.983 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.56 -52.93 62.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.69 0.796 . . . . 0.0 111.981 172.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.5 p -62.83 -22.69 66.83 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.044 0.938 . . . . 0.0 113.193 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.8 mttm -77.84 -42.53 33.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.631 1.573 . . . . 0.0 112.598 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -86.55 -38.56 17.06 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.167 0.987 . . . . 0.0 113.231 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 53.1 mt -88.51 -17.6 29.96 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.67 1.188 . . . . 0.0 113.186 -175.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.21 33.3 21.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 125.326 1.45 . . . . 0.0 113.168 -178.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.7 pt -89.86 163.94 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.772 2.029 . . . . 0.0 110.46 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.438 HG23 ' H ' ' A' ' 70' ' ' LYS . 11.0 t -72.39 151.7 42.48 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 121.578 -0.702 . . . . 0.0 110.926 165.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.4 t -57.4 -35.15 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 124.584 1.153 . . . . 0.0 111.372 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -71.73 -32.57 67.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.438 ' H ' HG23 ' A' ' 67' ' ' THR . 79.8 mttt -69.15 -36.43 77.41 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.789 169.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.6 70.61 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.199 0.909 . . . . 0.0 110.705 176.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -54.19 -42.06 69.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.017 1.727 . . . . 0.0 113.128 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.1 t -85.17 -39.53 17.75 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -59.53 -37.71 79.08 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.804 -1.185 . . . . 0.0 112.893 178.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.0 mt -48.2 -42.07 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.57 1.148 . . . . 0.0 111.914 174.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -95.19 -39.33 10.15 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.7 m120 . . . . . 0 CA--C 1.543 0.706 0 O-C-N 121.221 -0.925 . . . . 0.0 113.42 -175.719 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.42 27.29 4.79 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.429 1.892 . . . . 0.0 113.757 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.03 -16.41 22.73 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.146 0.978 . . . . 0.0 113.324 -179.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -74.38 12.35 0.78 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.655 1.982 . . . . 0.0 115.435 -171.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 6.5 47.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.076 2.151 . . . . 0.0 114.795 -167.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 96.8 m -142.88 -46.59 0.31 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.032 1.733 . . . . 0.0 110.135 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.7 pt -73.87 170.74 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.279 1.432 . . . . 0.0 111.955 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 64.97 -3.79 0.55 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.613 1.965 . . . . 0.0 116.17 176.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 21.6 ptt? -140.23 18.84 2.42 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -144.28 -31.83 0.44 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 . . . . . 0 CA--C 1.546 0.799 0 C-N-CA 125.293 1.437 . . . . 0.0 113.224 175.844 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 121.931 0.872 . . . . 0.0 112.07 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.9 t -99.16 -72.0 0.67 Allowed 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 125.587 1.555 . . . . 0.0 111.652 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -161.41 -46.56 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.949 0.499 . . . . 0.0 110.631 -174.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -56.11 -38.47 70.8 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.997 0.919 . . . . 0.0 110.469 172.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -67.37 -36.7 81.89 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.773 1.229 . . . . 0.0 111.8 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mtmt -69.07 -37.5 78.51 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 121.387 -0.821 . . . . 0.0 112.144 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -65.17 -2.44 2.92 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 170.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.7 mt -103.45 -60.98 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.253 1.421 . . . . 0.0 110.411 161.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.0 t -74.52 -53.58 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 CA-C-N 119.776 1.171 . . . . 0.0 113.128 -168.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.98 -34.3 78.11 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.579 -0.7 . . . . 0.0 110.853 177.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.96 -34.04 75.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 170.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.02 75.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.082 -1.011 . . . . 0.0 111.954 174.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.52 -32.17 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.171 -0.956 . . . . 0.0 110.697 172.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.5 m -74.96 -11.64 60.16 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -105.08 -39.45 6.22 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.291 1.405 . . . . 0.0 112.899 -172.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.6 p -129.35 -15.88 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -170.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.81 -85.43 0.23 Allowed Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.726 1.155 . . . . 0.0 111.919 171.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.3 tt -165.88 -41.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.727 1.611 . . . . 0.0 111.142 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -110.32 -6.68 14.94 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.883 1.673 . . . . 0.0 115.305 -169.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -95.89 -14.17 23.36 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 -173.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.88 159.69 24.95 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.349 1.459 . . . . 0.0 114.688 -178.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.7 t-20 -101.0 122.86 44.28 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.961 1.304 . . . . 0.0 111.474 -177.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.98 -21.13 64.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.866 1.266 . . . . 0.0 113.479 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 93.5 m -66.24 -41.33 90.18 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.399 -0.813 . . . . 0.0 111.491 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.91 -43.07 99.61 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.05 -1.031 . . . . 0.0 111.721 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -57.92 -44.56 86.91 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 112.286 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 p -61.86 -27.14 68.57 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.254 -0.904 . . . . 0.0 113.3 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -84.16 -38.5 20.58 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.807 1.643 . . . . 0.0 111.91 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.2 mmt-85 -91.17 -34.67 14.93 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.041 1.336 . . . . 0.0 114.276 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -92.96 -12.69 30.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.364 1.065 . . . . 0.0 112.937 174.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.73 65.33 1.25 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.056 1.343 . . . . 0.0 112.045 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -133.19 163.06 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.601 1.96 . . . . 0.0 111.586 -177.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.5 m -57.43 134.31 55.95 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.912 1.285 . . . . 0.0 109.65 163.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.8 t -59.1 -34.58 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 121.569 -0.707 . . . . 0.0 111.389 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.06 -29.01 64.78 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.249 -0.907 . . . . 0.0 113.363 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.71 -36.36 78.34 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.896 169.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.83 -50.13 65.72 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.08 0.855 . . . . 0.0 110.811 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -54.78 -38.83 67.73 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.195 1.398 . . . . 0.0 112.815 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.4 t -88.15 -34.98 17.67 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 177.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.64 -38.01 83.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.085 -1.009 . . . . 0.0 112.266 177.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.8 mt -48.01 -60.07 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.813 1.245 . . . . 0.0 110.954 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -75.04 -21.9 58.76 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 . . . . . 0 CA--C 1.543 0.706 0 CA-C-N 119.023 0.829 . . . . 0.0 112.83 176.367 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 53.91 21.51 2.85 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 125.698 1.599 . . . . 0.0 114.926 -172.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . 0.262 0.0 OUTLIER -101.9 27.6 6.39 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 120.042 -1.661 . . . . 0.0 113.07 -172.167 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -114.63 9.95 16.64 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.51 1.524 . . . . 0.0 113.809 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.0 pttt -93.91 -20.85 19.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.399 1.879 . . . . 0.0 115.041 -158.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 m -154.57 -51.48 0.09 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.335 1.854 . . . . 0.0 110.494 -169.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.7 pt -72.02 -174.66 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 111.382 171.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 65.03 -27.2 0.1 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.499 2.32 . . . . 0.0 116.386 -172.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -87.74 -18.57 29.15 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.943 1.247 . . . . 0.0 114.021 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -116.68 3.62 13.06 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.788 1.235 . . . . 0.0 114.135 178.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 . . . . . 0 N--CA 1.472 0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 112.782 -173.116 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 CA--C 1.535 0.374 0 CA-C-O 122.05 0.928 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.3 p -106.52 -83.05 0.53 Allowed 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.76 2.424 . . . . 0.0 111.688 -178.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -155.48 -48.97 0.08 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 124.664 1.186 . . . . 0.0 110.774 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.36 -28.55 69.36 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.497 0.719 . . . . 0.0 110.958 172.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -68.69 -37.1 79.3 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.231 1.012 . . . . 0.0 111.775 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -69.24 -34.06 74.24 Favored 'General case' 0 N--CA 1.481 1.112 0 O-C-N 120.788 -1.195 . . . . 0.0 112.971 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -63.56 -3.67 2.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 169.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.6 mt -109.01 -49.67 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.674 1.59 . . . . 0.0 110.687 168.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.96 -65.1 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.71 1.141 . . . . 0.0 112.321 -177.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.28 73.71 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.668 0.787 . . . . 0.0 111.439 -173.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.7 -43.17 94.18 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 170.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -72.0 -35.78 69.56 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.229 -0.92 . . . . 0.0 112.086 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.63 -29.16 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.916 1.286 . . . . 0.0 111.536 170.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.0 t -77.06 -17.46 58.75 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 173.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -95.55 -50.14 5.09 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.704 -1.247 . . . . 0.0 111.996 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.03 -7.1 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -168.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 116.19 -76.08 0.27 Allowed Glycine 0 N--CA 1.467 0.765 0 C-N-CA 125.476 1.512 . . . . 0.0 112.83 163.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -175.05 -33.85 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 127.031 2.133 . . . . 0.0 111.186 179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -111.72 -6.1 14.37 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.175 1.39 . . . . 0.0 114.536 -165.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -97.32 -21.33 17.29 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.159 0.984 . . . . 0.0 113.236 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.2 pp -68.09 167.05 14.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.53 0.732 . . . . 0.0 112.383 167.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -128.07 170.11 13.3 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.501 1.144 . . . . 0.0 112.28 174.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.94 -32.54 61.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.061 1.344 . . . . 0.0 112.947 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.42 -52.29 64.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.006 1.322 . . . . 0.0 111.149 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.29 -34.28 77.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.066 0.946 . . . . 0.0 112.341 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 tp -66.92 -47.98 70.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.008 0.523 . . . . 0.0 111.361 173.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -60.18 -25.36 65.51 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.853 1.261 . . . . 0.0 113.98 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -82.13 -16.73 48.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.006 1.723 . . . . 0.0 113.434 -177.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -119.85 -42.46 2.61 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.77 1.628 . . . . 0.0 112.137 -175.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tp -76.39 -12.42 60.05 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.371 1.868 . . . . 0.0 112.454 172.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.31 64.56 1.34 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.344 1.858 . . . . 0.0 112.592 170.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.8 pt -139.11 174.74 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 127.588 2.355 . . . . 0.0 109.966 -176.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.8 t -75.8 151.59 37.49 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.532 -0.73 . . . . 0.0 110.769 163.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.9 t -60.57 -34.28 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.025 0.93 . . . . 0.0 111.293 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.19 -31.92 72.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -69.23 -35.69 76.42 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.19 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.31 -45.13 73.81 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.02 0.827 . . . . 0.0 110.946 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.78 -39.12 73.5 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.079 1.351 . . . . 0.0 112.813 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -87.3 -40.38 14.54 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.21 -41.65 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.063 -1.023 . . . . 0.0 112.241 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.3 mt -54.68 -36.94 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 124.311 1.044 . . . . 0.0 112.695 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -92.93 -34.6 13.72 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.948 1.249 . . . . 0.0 113.001 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 . . . . . 0 CA--C 1.541 0.635 0 C-N-CA 123.162 0.585 . . . . 0.0 112.536 -170.796 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.8 t . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 122.429 1.109 . . . . 0.0 112.865 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 m120 53.46 20.1 1.91 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.08 2.152 . . . . 0.0 115.894 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -87.72 -4.85 58.89 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.086 1.354 . . . . 0.0 113.85 -175.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -75.93 8.79 2.83 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.484 1.914 . . . . 0.0 115.004 -166.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -85.73 -7.11 58.98 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.918 1.687 . . . . 0.0 114.704 -170.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.5 m -139.39 -43.89 0.45 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.216 1.807 . . . . 0.0 110.315 -165.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 40.1 pt -64.94 172.23 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.832 0.853 . . . . 0.0 111.92 170.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? 66.07 -18.28 0.11 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 127.387 2.275 . . . . 0.0 116.734 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.47 -15.55 8.02 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.402 1.456 . . . . 0.0 114.531 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -104.28 -25.36 12.91 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -165.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? . . . . . 0 CA--C 1.543 0.68 0 C-N-CA 123.7 0.8 . . . . 0.0 112.477 -176.632 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.3 mp . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.6 p -98.01 -71.16 0.7 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.375 1.07 . . . . 0.0 111.869 172.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -159.69 -29.05 0.06 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -170.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -85.86 -28.92 24.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.165 0.586 . . . . 0.0 110.684 173.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -78.03 -39.32 42.38 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.242 -0.911 . . . . 0.0 111.257 -167.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -68.34 -29.92 68.76 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.746 0.818 . . . . 0.0 112.566 171.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.11 -7.62 13.11 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -103.29 -56.47 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.956 1.302 . . . . 0.0 109.763 167.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -66.6 -55.84 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.753 1.16 . . . . 0.0 112.198 -173.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.92 78.93 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.739 -0.601 . . . . 0.0 111.253 -176.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -60.03 -42.72 95.0 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 170.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.21 -36.13 76.94 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.309 1.044 . . . . 0.0 112.047 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -58.81 -35.62 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 O-C-N 120.859 -1.151 . . . . 0.0 111.399 174.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.6 m -70.45 -12.3 61.49 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 173.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -91.69 -43.73 9.42 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.14 1.337 . . . . 0.0 112.178 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.1 -10.71 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -165.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 125.02 -79.36 0.36 Allowed Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.714 1.149 . . . . 0.0 111.696 170.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -171.23 -43.84 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.559 1.944 . . . . 0.0 111.438 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -106.73 -12.04 15.64 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.996 1.719 . . . . 0.0 114.667 -167.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -90.12 -21.7 22.13 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -175.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.07 164.59 8.2 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.664 1.186 . . . . 0.0 113.224 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.97 164.9 12.87 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.383 1.087 . . . . 0.0 112.139 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.88 -29.38 44.39 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.707 1.203 . . . . 0.0 113.269 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -59.81 -43.58 94.42 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 0.0 111.767 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.92 -25.81 65.66 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.637 -1.29 . . . . 0.0 113.545 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.75 -50.32 17.79 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.978 0.808 . . . . 0.0 111.445 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.3 p -59.94 -26.06 65.67 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -76.24 -26.79 56.37 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 114.074 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 78.8 mtt85 -113.87 -39.35 4.0 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.078 1.351 . . . . 0.0 113.112 -172.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 tt -84.08 -19.35 34.45 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.404 1.881 . . . . 0.0 111.112 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 60.32 72.71 0.51 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.706 2.002 . . . . 0.0 112.473 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.8 pt -135.28 164.4 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 127.367 2.267 . . . . 0.0 110.356 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.5 m -62.9 140.35 58.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.739 1.216 . . . . 0.0 109.913 166.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.9 t -57.54 -38.65 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 O-C-N 121.483 -0.76 . . . . 0.0 111.436 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.06 -26.79 60.59 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.447 -0.783 . . . . 0.0 113.102 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.39 -37.54 80.47 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 118.104 -0.95 . . . . 0.0 110.597 167.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.0 -47.51 74.24 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.286 0.948 . . . . 0.0 111.54 176.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.74 -43.77 85.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.931 1.292 . . . . 0.0 112.498 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -84.62 -34.34 23.13 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -55.37 -48.36 74.4 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.376 1.07 . . . . 0.0 111.266 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.7 mt -46.13 -59.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.752 1.221 . . . . 0.0 110.472 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -87.5 -3.22 59.0 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -172.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 . . . . . 0 N--CA 1.473 0.719 0 CA-C-N 119.256 0.935 . . . . 0.0 112.66 170.596 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.4 m120 55.44 24.0 6.33 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 116.644 2.09 . . . . 0.0 116.644 168.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -108.77 -0.51 19.92 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.384 1.474 . . . . 0.0 114.038 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -76.28 19.68 0.24 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.847 1.659 . . . . 0.0 114.671 -175.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt -93.51 -2.11 54.78 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 127.103 2.161 . . . . 0.0 114.262 -162.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.1 m -148.33 -46.04 0.15 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.936 2.494 . . . . 0.0 108.763 -170.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.3 pt -73.07 161.2 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 111.424 169.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.6 mptt 61.38 18.79 9.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.526 1.53 . . . . 0.0 114.812 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 38.8 mtt -124.67 -44.96 1.94 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.833 1.253 . . . . 0.0 113.172 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -115.77 27.33 9.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.664 1.586 . . . . 0.0 112.074 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 CA--C 1.541 0.605 0 C-N-CA 126.199 1.8 . . . . 0.0 112.075 -167.489 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.468 0.459 0 CA-C-O 121.325 0.583 . . . . 0.0 111.752 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.4 m -102.71 -72.36 0.69 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.493 1.517 . . . . 0.0 112.227 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -162.47 -44.39 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.176 0.59 . . . . 0.0 111.498 -173.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -61.26 -33.78 74.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.588 0.755 . . . . 0.0 110.916 170.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -68.77 -37.58 79.45 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.626 1.171 . . . . 0.0 111.645 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt -66.32 -35.21 79.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.146 -0.972 . . . . 0.0 112.831 171.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -65.06 -1.33 2.04 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 171.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.6 mt -113.58 -14.39 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 126.354 1.862 . . . . 0.0 112.098 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -124.73 -58.96 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.124 0.97 . . . . 0.0 112.642 -174.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.15 -37.75 86.38 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.423 1.011 . . . . 0.0 111.089 175.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.21 -32.03 73.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.713 0.805 . . . . 0.0 113.049 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -77.51 -38.4 48.97 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.027 0.931 . . . . 0.0 111.871 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.14 -33.05 52.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.7 1.2 . . . . 0.0 110.462 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -71.14 -16.38 62.55 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 171.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -104.79 -42.91 5.24 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.681 -1.262 . . . . 0.0 113.024 -171.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.2 m -127.61 -13.21 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -172.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -82.52 0.31 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 125.056 1.313 . . . . 0.0 112.195 168.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 tt -171.75 -43.86 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 111.342 -178.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -112.26 -4.08 14.44 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.003 1.721 . . . . 0.0 114.932 -168.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -93.37 -22.3 19.02 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 112.792 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 pp -66.77 165.72 14.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.946 1.298 . . . . 0.0 112.313 164.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -118.24 172.53 7.38 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.394 1.093 . . . . 0.0 111.599 171.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.0 58.0 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.686 1.194 . . . . 0.0 112.815 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -65.42 -48.06 74.11 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.729 1.611 . . . . 0.0 112.194 -173.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -66.47 -29.57 69.72 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.734 -1.229 . . . . 0.0 112.686 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.29 -46.97 25.43 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.326 1.45 . . . . 0.0 110.293 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.6 p -67.89 -29.3 68.37 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.02 1.328 . . . . 0.0 113.469 177.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -66.81 -39.4 87.72 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.866 1.266 . . . . 0.0 112.675 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 83.4 mtt85 -86.99 -42.08 13.4 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.384 1.074 . . . . 0.0 113.28 -179.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 tt -81.26 -18.35 46.27 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.129 1.372 . . . . 0.0 111.829 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 62.67 68.3 0.66 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.604 1.961 . . . . 0.0 112.08 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.1 pt -135.41 177.63 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 127.231 2.213 . . . . 0.0 110.833 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.7 m -73.15 144.4 46.92 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.703 1.601 . . . . 0.0 109.813 166.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.7 t -58.79 -39.89 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 O-C-N 121.442 -0.786 . . . . 0.0 111.434 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -69.63 -30.29 67.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.0 mmtt -64.5 -38.42 90.97 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.161 170.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.61 -48.26 64.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.909 0.777 . . . . 0.0 110.216 175.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -56.34 -42.63 78.04 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.837 1.255 . . . . 0.0 112.891 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 t -82.21 -38.11 25.04 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -61.59 -36.8 81.72 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.861 -1.149 . . . . 0.0 112.937 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.3 mt -49.84 -45.77 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.154 0.981 . . . . 0.0 111.191 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -93.31 -13.0 28.71 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.259 1.578 . . . . 0.0 115.259 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.2 m120 . . . . . 0 N--CA 1.472 0.632 0 CA-C-N 119.843 1.201 . . . . 0.0 112.409 169.175 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 57.3 p . . . . . 0 N--CA 1.478 0.954 0 CA-C-O 122.779 1.276 . . . . 0.0 114.334 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -75.95 -5.28 45.47 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.62 1.568 . . . . 0.0 112.228 -171.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.94 -20.15 66.11 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 128.712 2.805 . . . . 0.0 113.592 173.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -66.66 12.56 0.07 Allowed 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.949 2.203 . . . . 0.0 116.949 -172.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -5.58 59.32 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 -169.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.7 m -139.0 -47.44 0.48 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.445 1.498 . . . . 0.0 110.806 -167.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 pt -71.12 165.1 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 124.192 0.997 . . . . 0.0 111.828 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? 65.24 -14.45 0.11 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 126.787 2.035 . . . . 0.0 116.417 176.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 49.4 mtm -85.21 -43.55 13.69 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.787 1.176 . . . . 0.0 112.783 -176.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -103.75 -7.6 20.48 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -176.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.545 0.773 0 C-N-CA 124.59 1.156 . . . . 0.0 110.757 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.542 0.649 0 CA-C-O 122.677 1.227 . . . . 0.0 113.424 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.5 t -127.72 78.96 1.86 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.041 1.737 . . . . 0.0 111.585 -161.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 59.34 18.73 6.98 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.493 1.917 . . . . 0.0 116.105 166.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -144.58 -38.88 0.28 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.124 1.77 . . . . 0.0 110.916 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -67.03 -47.2 72.14 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.298 -0.876 . . . . 0.0 111.678 -178.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -65.78 -25.77 67.41 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.86 -1.15 . . . . 0.0 113.125 171.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -69.01 -11.04 60.42 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 169.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.0 mt -95.46 -51.49 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.114 1.365 . . . . 0.0 109.82 165.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.48 -60.05 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.569 0.748 . . . . 0.0 111.829 -169.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.0 -28.55 65.6 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.167 0.44 . . . . 0.0 111.659 -176.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.28 -43.44 87.98 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 165.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -38.36 88.97 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.173 0.897 . . . . 0.0 111.836 174.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.1 mm -57.05 -35.02 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 120.473 -1.392 . . . . 0.0 111.076 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -75.61 -8.41 56.7 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.385 1.624 . . . . 0.0 115.385 173.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.51 -53.43 4.06 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.473 1.488 . . . . 0.0 111.956 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.1 m -120.77 -13.93 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 -165.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.41 -75.25 0.43 Allowed Glycine 0 N--CA 1.469 0.854 0 C-N-CA 124.57 1.081 . . . . 0.0 112.998 164.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 51.4 tp -164.94 -43.57 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.656 1.182 . . . . 0.0 112.215 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -112.4 -5.35 14.11 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.944 1.298 . . . . 0.0 114.393 -168.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -92.93 -15.1 26.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.125 0.97 . . . . 0.0 113.212 -174.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -68.25 166.42 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 166.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -115.82 167.58 10.81 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 122.48 1.133 . . . . 0.0 111.789 170.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.38 -22.89 38.02 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.402 1.081 . . . . 0.0 112.577 -179.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -66.1 -49.57 67.09 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.777 1.631 . . . . 0.0 111.441 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -64.06 -43.79 94.4 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.049 -1.032 . . . . 0.0 111.917 178.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -55.98 -58.48 7.74 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.642 0.777 . . . . 0.0 111.386 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.7 p -61.36 -21.33 63.94 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -78.81 -43.15 25.93 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.897 1.279 . . . . 0.0 112.345 175.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -79.7 -34.12 40.45 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.945 1.298 . . . . 0.0 113.234 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.8 mt -87.31 -23.8 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.955 1.702 . . . . 0.0 113.548 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.17 49.16 9.54 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.083 1.353 . . . . 0.0 112.262 -174.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.9 pt -107.24 172.44 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 126.738 2.015 . . . . 0.0 110.712 169.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 m -71.38 137.93 48.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.283 1.433 . . . . 0.0 109.538 165.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -56.28 -38.83 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.778 0.831 . . . . 0.0 111.672 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -72.92 -22.18 60.77 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -75.23 -37.07 61.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.696 166.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.9 -47.81 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.387 0.54 . . . . 0.0 110.813 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -51.46 -37.17 47.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.313 1.845 . . . . 0.0 113.567 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.5 t -96.26 -30.64 13.34 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -63.85 -32.37 73.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.003 -1.061 . . . . 0.0 112.499 174.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 33.2 mt -50.92 -27.11 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.54 1.536 . . . . 0.0 112.791 173.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -115.34 -26.02 7.76 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 176.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 . . . . . 0 CA--C 1.551 1.017 0 C-N-CA 124.906 1.282 . . . . 0.0 112.542 171.259 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.5 p . . . . . 0 N--CA 1.482 1.127 0 N-CA-C 115.531 1.678 . . . . 0.0 115.531 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 50.85 15.01 0.21 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.434 1.893 . . . . 0.0 115.193 -164.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -14.21 58.97 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 120.018 -1.676 . . . . 0.0 113.378 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -73.88 14.94 0.33 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.841 2.056 . . . . 0.0 114.167 176.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -81.43 5.05 18.82 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.835 2.454 . . . . 0.0 114.436 -173.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 51.5 m -144.55 -46.59 0.25 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 127.066 2.146 . . . . 0.0 110.097 -170.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.5 mt -70.72 159.65 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.938 1.295 . . . . 0.0 109.223 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.5 mmtp 67.73 0.85 2.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.655 1.982 . . . . 0.0 116.211 177.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.9 mtm -106.66 -42.63 4.92 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.22 -21.48 31.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.792 0.837 . . . . 0.0 113.117 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 . . . . . 0 CA--C 1.544 0.728 0 C-N-CA 126.246 1.818 . . . . 0.0 110.939 178.21 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 CA--C 1.535 0.383 0 CA-C-O 121.471 0.653 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.3 t -113.25 -73.09 0.68 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.268 1.827 . . . . 0.0 112.043 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -161.86 -45.86 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.28 0.632 . . . . 0.0 111.19 -171.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.69 -32.23 73.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.534 0.734 . . . . 0.0 111.124 173.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -67.79 -35.36 78.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.129 0.972 . . . . 0.0 111.601 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -69.69 -35.07 74.76 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.295 -0.878 . . . . 0.0 112.667 171.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.71 -5.98 3.2 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.27 -24.56 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.81 1.644 . . . . 0.0 112.382 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.433 HG22 HD22 ' A' ' 60' ' ' LEU . 51.2 t -112.75 -59.59 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 124.597 1.159 . . . . 0.0 112.598 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.26 -33.11 73.99 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.269 -0.894 . . . . 0.0 111.893 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -68.71 -30.85 69.58 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.182 0.993 . . . . 0.0 113.208 171.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -76.65 -37.85 55.57 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.873 1.269 . . . . 0.0 111.623 177.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.47 -40.0 65.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 O-C-N 121.062 -1.023 . . . . 0.0 110.085 167.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -73.11 -6.22 44.24 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -110.03 -30.96 7.55 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.331 1.423 . . . . 0.0 113.261 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.1 p -135.2 -16.54 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -173.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.96 -83.49 0.28 Allowed Glycine 0 N--CA 1.469 0.886 0 C-N-CA 125.098 1.332 . . . . 0.0 111.683 171.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 tt -166.31 -44.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.082 1.753 . . . . 0.0 110.551 177.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -107.55 -6.73 16.81 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.224 1.81 . . . . 0.0 115.155 -168.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.36 -16.94 24.1 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.911 0.778 . . . . 0.0 112.862 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -63.46 163.76 10.37 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.181 1.392 . . . . 0.0 112.754 167.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -112.69 170.6 8.07 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.233 1.016 . . . . 0.0 111.47 170.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -21.66 31.72 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.424 1.089 . . . . 0.0 112.72 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -65.24 -45.35 85.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.809 1.643 . . . . 0.0 112.219 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -65.46 -36.48 84.0 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.556 -1.34 . . . . 0.0 111.993 176.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.433 HD22 HG22 ' A' ' 43' ' ' VAL . 47.2 mt -65.89 -47.25 75.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.182 0.593 . . . . 0.0 112.146 173.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.8 p -63.9 -31.05 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.11 -0.994 . . . . 0.0 113.036 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -71.47 -43.6 66.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.338 1.455 . . . . 0.0 112.834 176.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -94.78 -37.11 11.41 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -86.28 -15.36 40.95 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.446 1.499 . . . . 0.0 111.568 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 59.82 67.18 0.9 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.244 1.818 . . . . 0.0 112.657 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.1 pt -136.87 161.64 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 128.399 2.68 . . . . 0.0 109.022 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 70' ' ' LYS . 15.3 t -68.4 153.17 44.29 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.364 -0.835 . . . . 0.0 110.751 167.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.99 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.679 0.792 . . . . 0.0 111.126 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.06 -31.5 70.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.407 ' H ' HG23 ' A' ' 67' ' ' THR . 27.7 mttm -64.93 -40.69 95.44 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.62 170.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.33 -49.18 65.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.651 0.66 . . . . 0.0 110.64 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -54.35 -42.47 70.29 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.438 1.495 . . . . 0.0 112.483 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -85.15 -38.06 19.47 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.509 0.595 . . . . 0.0 112.526 -178.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -61.74 -35.73 78.93 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.054 -1.029 . . . . 0.0 112.984 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.9 mt -47.69 -55.27 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.194 0.998 . . . . 0.0 110.719 172.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -77.4 -30.32 53.53 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.3 m120 . . . . . 0 N--CA 1.472 0.653 0 CA-C-N 120.098 1.317 . . . . 0.0 112.268 175.96 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 44.75 36.73 1.93 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.095 1.758 . . . . 0.0 114.707 -168.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.27 -5.65 24.03 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.329 . . . . 0.0 113.851 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -71.63 17.25 0.09 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.634 1.974 . . . . 0.0 114.082 174.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.9 pttt -84.46 -10.4 57.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 128.056 2.542 . . . . 0.0 113.116 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 85.4 m -137.03 -42.7 0.57 Allowed 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.558 1.943 . . . . 0.0 111.24 -175.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.5 mt -71.19 153.42 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.829 0.852 . . . . 0.0 108.881 167.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm 66.68 -4.66 0.72 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 170.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -82.18 -26.89 32.99 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.939 0.79 . . . . 0.0 113.032 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -114.91 -10.67 12.29 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.063 1.345 . . . . 0.0 113.95 -175.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 . . . . . 0 N--CA 1.472 0.636 0 C-N-CA 125.406 1.482 . . . . 0.0 111.988 -179.834 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.54 0.589 0 CA-C-O 121.809 0.814 . . . . 0.0 111.317 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.2 m -134.05 71.36 1.45 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.662 1.985 . . . . 0.0 111.3 -173.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 66.44 8.76 5.97 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 163.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -128.44 -32.6 2.18 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.27 1.028 . . . . 0.0 111.903 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -76.1 -42.71 46.33 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.978 1.311 . . . . 0.0 111.407 -170.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.25 -31.02 72.06 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.179 0.992 . . . . 0.0 112.846 166.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -68.21 -3.48 10.8 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 169.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -103.54 -55.96 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.287 1.435 . . . . 0.0 109.579 166.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.8 t -74.18 -50.69 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 CA-C-N 119.308 0.958 . . . . 0.0 113.075 -170.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.09 -34.72 78.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.88 0.764 . . . . 0.0 111.084 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.05 -35.52 77.15 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 170.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.51 -39.72 70.6 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.182 -0.949 . . . . 0.0 111.521 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -36.82 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 O-C-N 120.601 -1.312 . . . . 0.0 110.944 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.8 m -70.83 -11.49 60.99 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 171.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -104.48 -42.24 5.5 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.318 1.417 . . . . 0.0 112.873 -172.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.9 m -128.81 -13.36 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.49 -79.2 0.34 Allowed Glycine 0 N--CA 1.47 0.923 0 C-N-CA 125.075 1.322 . . . . 0.0 112.504 164.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 tp -159.8 -47.33 0.05 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.371 1.068 . . . . 0.0 112.143 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -106.34 -13.39 15.39 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.684 1.594 . . . . 0.0 114.307 -170.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -87.16 -11.04 51.15 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -171.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.4 pp -69.9 175.1 4.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.166 1.786 . . . . 0.0 113.975 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -117.68 120.85 39.26 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.083 0.953 . . . . 0.0 111.964 -178.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.11 -24.91 68.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.289 0.636 . . . . 0.0 112.641 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.0 m -69.38 -43.6 73.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.9 1.28 . . . . 0.0 112.1 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -63.51 -38.51 91.4 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.266 -1.521 . . . . 0.0 111.763 173.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.73 -51.29 69.98 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.775 0.43 . . . . 0.0 111.633 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 98.6 p -65.26 -26.8 68.25 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -74.17 -46.44 42.23 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.608 1.563 . . . . 0.0 112.07 175.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.3 mmt-85 -72.8 -42.9 63.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.846 1.258 . . . . 0.0 113.127 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -92.38 -20.34 21.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.102 1.761 . . . . 0.0 112.249 -170.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 62.25 68.17 0.69 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.279 1.832 . . . . 0.0 112.844 -178.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.5 pt -132.35 173.97 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 128.55 2.74 . . . . 0.0 108.527 174.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.423 HG23 ' H ' ' A' ' 70' ' ' LYS . 12.7 t -78.36 152.94 32.04 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 121.126 -0.983 . . . . 0.0 110.573 165.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.6 t -57.49 -36.45 53.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.093 0.957 . . . . 0.0 111.134 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.46 -33.8 75.87 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.423 ' H ' HG23 ' A' ' 67' ' ' THR . 43.6 mtmt -69.2 -33.45 73.37 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.049 -0.976 . . . . 0.0 111.396 172.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -49.67 54.26 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.548 1.067 . . . . 0.0 110.679 174.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -55.15 -39.23 69.25 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.439 1.496 . . . . 0.0 112.796 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.6 t -83.88 -41.16 17.73 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -59.93 -34.32 73.08 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 120.862 -1.149 . . . . 0.0 112.835 -179.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.09 -64.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.657 1.183 . . . . 0.0 110.408 171.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.71 -21.98 60.96 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -179.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 CA--C 1.541 0.613 0 CA-C-N 119.081 0.855 . . . . 0.0 112.725 -178.934 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.3 p . . . . . 0 N--CA 1.483 1.185 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 48.94 25.98 1.21 Allowed 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 125.83 1.652 . . . . 0.0 114.77 -166.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.52 -8.81 28.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.493 1.517 . . . . 0.0 113.805 -178.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -70.9 15.36 0.11 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.367 2.267 . . . . 0.0 115.569 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -77.39 1.87 17.69 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 126.703 2.001 . . . . 0.0 114.756 -172.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.4 m -147.6 -48.89 0.17 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.707 2.003 . . . . 0.0 110.297 -170.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.7 mt -71.31 156.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.649 1.18 . . . . 0.0 109.533 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? 68.23 -4.92 0.97 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.991 2.116 . . . . 0.0 116.118 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.7 mtm -102.99 -43.09 5.61 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -94.11 -9.07 37.74 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 . . . . . 0 CA--C 1.541 0.625 0 C-N-CA 125.325 1.45 . . . . 0.0 112.222 -175.893 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 CA--C 1.535 0.37 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.5 m -120.46 -66.76 1.03 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.802 1.641 . . . . 0.0 112.162 177.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -163.6 -48.91 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.0 110.453 -170.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.61 72.89 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.937 177.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -68.92 -34.42 75.36 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.185 0.994 . . . . 0.0 111.921 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -69.63 -33.62 72.9 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.88 -1.138 . . . . 0.0 111.847 171.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -67.09 -1.16 3.9 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 170.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.1 mt -112.53 -26.86 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.523 1.929 . . . . 0.0 112.44 171.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.2 t -107.95 -59.91 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.749 1.159 . . . . 0.0 112.378 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.37 93.81 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.767 0.827 . . . . 0.0 111.701 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -66.47 -38.44 87.33 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -71.38 -32.05 68.01 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.619 1.168 . . . . 0.0 112.677 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.56 -31.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.08 0.952 . . . . 0.0 111.768 167.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 t -74.71 -17.16 60.7 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.479 0.712 . . . . 0.0 112.86 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -90.61 -44.21 9.68 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.223 -0.923 . . . . 0.0 111.318 176.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 84.9 t -108.12 -48.85 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -167.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.34 -79.84 0.18 Allowed Glycine 0 N--CA 1.469 0.894 0 CA-C-N 118.182 0.446 . . . . 0.0 114.053 170.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 tt -172.63 -39.3 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.805 1.642 . . . . 0.0 113.331 -173.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -121.62 -9.69 8.89 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.616 1.567 . . . . 0.0 114.984 -168.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -3.29 28.09 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -172.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.38 157.43 37.06 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.59 1.956 . . . . 0.0 113.961 -170.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -85.38 104.93 15.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.214 1.006 . . . . 0.0 109.726 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.78 -24.39 61.72 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.347 0.659 . . . . 0.0 112.349 171.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -58.67 -46.03 88.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.426 1.89 . . . . 0.0 112.405 169.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -63.63 -37.64 88.11 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.307 -1.495 . . . . 0.0 112.423 175.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.19 -49.82 70.53 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.566 0.621 . . . . 0.0 112.174 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.1 p -64.53 -22.96 67.11 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.235 -0.916 . . . . 0.0 113.468 -179.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -81.76 -14.47 56.41 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.608 1.563 . . . . 0.0 113.751 175.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -119.99 -42.18 2.61 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.227 1.411 . . . . 0.0 113.582 -172.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.1 mp -85.85 -12.01 51.88 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.868 1.267 . . . . 0.0 112.603 172.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.67 63.97 1.55 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.313 1.445 . . . . 0.0 111.905 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -128.22 167.19 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 126.937 2.095 . . . . 0.0 111.45 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.8 m -63.86 141.46 58.76 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.72 1.208 . . . . 0.0 109.721 167.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.74 -36.94 68.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.251 -0.905 . . . . 0.0 111.437 -178.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -72.83 -28.71 62.71 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 177.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -66.05 -40.07 90.63 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.524 -0.75 . . . . 0.0 110.519 168.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.75 -47.82 73.95 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.91 0.777 . . . . 0.0 111.14 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.51 -38.69 69.53 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.451 1.5 . . . . 0.0 112.942 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -88.76 -34.95 16.94 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.96 -34.91 79.05 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.73 1.212 . . . . 0.0 112.884 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.6 mt -50.29 -36.36 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.735 1.214 . . . . 0.0 112.096 173.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -92.01 -43.95 9.14 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.969 0.908 . . . . 0.0 112.799 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 . . . . . 0 CA--C 1.545 0.764 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -172.494 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.478 0.96 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 56.5 7.92 0.4 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 126.72 2.008 . . . . 0.0 115.543 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -12.44 59.99 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 119.992 -1.692 . . . . 0.0 113.906 -173.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -72.61 13.15 0.39 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 127.085 2.154 . . . . 0.0 114.835 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -91.32 -4.3 55.96 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.727 2.411 . . . . 0.0 114.64 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 63.6 m -138.61 -49.36 0.53 Allowed 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.994 1.718 . . . . 0.0 110.343 -172.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 44.1 pt -70.44 164.67 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.49 1.116 . . . . 0.0 111.873 176.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 65.14 -9.54 0.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 127.263 2.225 . . . . 0.0 116.346 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 46.0 mtm -93.29 -39.49 10.94 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.781 1.173 . . . . 0.0 113.945 -175.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -120.69 0.84 10.49 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -173.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 . . . . . 0 CA--C 1.541 0.617 0 C-N-CA 124.477 1.111 . . . . 0.0 111.149 -175.849 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp . . . . . 0 C--O 1.233 0.217 0 CA-C-O 122.021 0.915 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.5 t -92.06 -69.79 0.72 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.312 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -161.8 -29.95 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.64 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -99.39 0.07 41.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.996 1.318 . . . . 0.0 112.311 177.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -106.39 -37.11 6.61 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.189 0.904 . . . . 0.0 112.87 175.603 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -65.15 -29.41 70.24 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.776 -1.202 . . . . 0.0 112.515 174.331 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -65.66 -6.38 11.16 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.829 1.252 . . . . 0.0 114.147 170.263 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.0 mp -104.89 -55.81 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 125.52 1.528 . . . . 0.0 110.116 167.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.9 t -65.05 -55.93 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 119.435 1.016 . . . . 0.0 111.613 -172.324 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.96 65.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -175.397 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -34.4 73.8 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.645 -0.659 . . . . 0.0 112.572 166.849 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.72 -37.95 70.57 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.25 0.932 . . . . 0.0 111.796 172.711 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -60.16 -31.16 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 120.491 -1.381 . . . . 0.0 110.899 173.053 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 t -74.28 -13.17 60.73 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 171.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -102.05 -43.98 5.6 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.529 -1.357 . . . . 0.0 112.959 -167.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.06 -11.7 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -169.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 135.47 -86.44 0.25 Allowed Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.767 1.175 . . . . 0.0 111.462 170.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -162.56 -44.74 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.599 1.56 . . . . 0.0 111.109 176.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -104.24 -13.44 16.18 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.516 1.526 . . . . 0.0 114.596 -168.591 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -85.99 -16.28 38.82 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.112 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -66.33 159.78 26.03 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.981 1.312 . . . . 0.0 113.815 179.12 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -104.23 117.97 35.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.225 1.01 . . . . 0.0 110.747 178.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.56 -24.4 66.62 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.519 1.127 . . . . 0.0 113.63 178.84 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.6 m -68.22 -40.72 81.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.041 0.936 . . . . 0.0 111.769 173.638 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -68.01 -29.19 68.13 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.353 -1.467 . . . . 0.0 113.007 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.64 -57.71 7.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.932 0.893 . . . . 0.0 111.345 165.616 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.0 p -60.44 -24.64 65.36 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.38 1.072 . . . . 0.0 113.657 -174.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -67.98 -24.51 65.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.496 1.918 . . . . 0.0 114.257 173.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 mtm-85 -112.65 -37.08 5.01 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.818 1.647 . . . . 0.0 113.411 -179.672 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -73.8 -17.83 61.03 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.108 0.963 . . . . 0.0 112.45 171.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 57.69 49.9 11.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.64 1.576 . . . . 0.0 111.626 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.0 pt -113.98 175.37 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 127.254 2.222 . . . . 0.0 110.952 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.4 m -71.96 137.57 47.41 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.726 1.61 . . . . 0.0 108.854 165.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.5 t -57.04 -40.13 70.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 O-C-N 121.782 -0.574 . . . . 0.0 111.139 -178.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.18 -26.95 63.19 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.335 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -68.23 -39.33 82.34 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.739 168.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.05 -49.09 73.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.461 1.028 . . . . 0.0 110.433 175.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -54.55 -41.42 69.76 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.492 1.517 . . . . 0.0 112.866 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -87.08 -33.32 19.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 177.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -61.91 -38.94 90.26 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.072 -1.017 . . . . 0.0 112.508 178.072 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.7 mt -46.86 -58.04 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.093 1.357 . . . . 0.0 110.358 173.581 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -72.89 -33.21 65.9 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.413 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 . . . . . 0 N--CA 1.471 0.594 0 CA-C-N 119.202 0.91 . . . . 0.0 113.181 -178.704 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.8 p . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 48.55 27.31 1.42 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.317 1.847 . . . . 0.0 114.388 -168.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.8 -10.33 24.97 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.738 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -70.72 10.72 0.46 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.197 2.199 . . . . 0.0 116.38 -169.302 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -87.1 -9.56 55.04 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.322 1.849 . . . . 0.0 114.817 -169.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.1 m -140.56 -44.09 0.4 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.778 1.631 . . . . 0.0 110.61 -165.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.0 pt -62.59 169.4 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 124.402 1.081 . . . . 0.0 111.697 169.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt 69.13 -19.99 0.17 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.574 1.949 . . . . 0.0 115.95 176.293 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 17.1 ptp -124.44 6.99 8.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.437 1.495 . . . . 0.0 113.79 -175.699 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -146.89 -30.51 0.35 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.27 1.428 . . . . 0.0 113.331 -167.588 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 126.148 1.779 . . . . 0.0 112.41 -179.837 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 C--O 1.234 0.244 0 CA-C-O 121.894 0.854 . . . . 0.0 110.46 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -104.74 -75.07 0.63 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.894 1.678 . . . . 0.0 111.648 -178.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -158.83 -40.65 0.06 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.61 -31.5 71.57 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 122.178 -0.326 . . . . 0.0 110.897 172.348 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -71.01 -44.81 65.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.644 0.778 . . . . 0.0 112.004 -171.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt -71.41 -22.54 61.85 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.54 -1.35 . . . . 0.0 112.977 175.625 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -70.87 1.48 5.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.997 1.319 . . . . 0.0 113.973 164.814 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 mt -115.31 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.136 1.774 . . . . 0.0 110.319 168.652 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.26 -62.3 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.047 1.294 . . . . 0.0 112.069 -178.613 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.36 -33.19 74.7 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.646 -0.659 . . . . 0.0 110.991 -177.183 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.29 -23.3 65.59 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 169.608 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.67 -40.73 17.06 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.461 1.028 . . . . 0.0 111.216 172.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.61 -35.44 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.995 -1.065 . . . . 0.0 111.499 176.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.8 p -76.8 -5.21 47.32 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 174.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -98.76 -54.17 3.08 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.331 1.423 . . . . 0.0 112.055 177.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -115.58 -16.36 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -166.109 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.65 -78.88 0.36 Allowed Glycine 0 N--CA 1.467 0.717 0 C-N-CA 125.494 1.521 . . . . 0.0 111.579 167.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -165.94 -45.24 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.842 1.257 . . . . 0.0 112.141 174.148 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -97.33 -14.9 21.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.208 1.803 . . . . 0.0 114.381 -172.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -87.68 -15.62 36.65 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -171.683 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -67.69 165.35 17.37 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.914 1.285 . . . . 0.0 112.115 165.023 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.6 p30 -119.35 169.46 9.98 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.466 1.127 . . . . 0.0 112.043 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.2 -26.5 39.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.667 1.187 . . . . 0.0 112.819 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -63.71 -51.58 64.38 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.953 1.301 . . . . 0.0 111.275 -179.161 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -62.89 -39.03 93.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.528 0.731 . . . . 0.0 111.587 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.33 -46.03 90.52 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.294 0.637 . . . . 0.0 111.608 174.289 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.4 p -62.04 -25.81 67.89 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.984 -1.073 . . . . 0.0 113.685 177.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -84.27 -39.05 19.72 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.487 1.515 . . . . 0.0 112.021 -177.187 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -91.16 -38.68 12.58 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.259 1.024 . . . . 0.0 113.348 -179.762 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.01 -19.88 42.99 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.561 1.144 . . . . 0.0 113.072 177.976 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 61.76 69.33 0.65 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.876 1.67 . . . . 0.0 112.143 -177.49 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.5 pt -137.42 168.39 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 126.734 2.013 . . . . 0.0 111.467 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.7 m -60.81 139.21 58.01 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.413 1.485 . . . . 0.0 110.147 162.496 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -61.12 -35.29 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.28 -0.887 . . . . 0.0 111.511 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.79 -30.01 66.36 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.095 -1.003 . . . . 0.0 113.377 177.551 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.47 -40.05 94.96 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.82 167.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.07 -48.42 73.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.194 0.906 . . . . 0.0 110.962 177.254 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -56.1 -40.84 74.29 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.797 1.239 . . . . 0.0 112.476 179.474 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -88.4 -33.68 17.81 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.19 -38.31 90.69 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.237 1.015 . . . . 0.0 112.359 177.48 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.5 mt -48.92 -52.54 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.216 1.006 . . . . 0.0 110.651 175.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -80.85 -32.33 35.09 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 . . . . . 0 CA--C 1.541 0.634 0 CA-C-N 119.882 1.219 . . . . 0.0 113.179 -179.024 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.845 0 N-CA-C 115.09 1.515 . . . . 0.0 115.09 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.8 m120 48.45 32.36 3.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.887 1.675 . . . . 0.0 113.436 -167.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.29 -5.38 19.17 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.254 1.422 . . . . 0.0 114.478 -179.464 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -75.45 13.82 0.7 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.512 1.925 . . . . 0.0 115.526 -168.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -91.47 11.85 22.65 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.685 1.994 . . . . 0.0 113.752 -163.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.6 m -150.94 -47.84 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.658 2.783 . . . . 0.0 108.604 -169.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -73.99 156.08 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.224 1.01 . . . . 0.0 109.454 179.371 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.47 -7.11 0.57 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 127.411 2.284 . . . . 0.0 116.438 -178.683 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 37.2 mtm -96.91 -50.59 4.58 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.946 1.248 . . . . 0.0 113.678 -174.705 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -91.41 -7.67 50.05 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -176.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 . . . . . 0 N--CA 1.474 0.757 0 C-N-CA 125.221 1.408 . . . . 0.0 114.247 -168.699 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp . . . . . 0 CA--C 1.543 0.678 0 N-CA-C 113.894 1.072 . . . . 0.0 113.894 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -82.73 -71.37 0.5 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.996 0.918 . . . . 0.0 112.726 -175.536 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -163.57 -35.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.101 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -29.22 47.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.74 0.416 . . . . 0.0 111.095 170.906 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -77.62 -42.64 34.21 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.569 1.548 . . . . 0.0 112.045 -168.576 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -68.73 -26.14 65.11 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.228 -0.92 . . . . 0.0 113.035 173.752 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -68.9 -1.09 6.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.164 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 mt -113.86 -45.23 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.414 1.486 . . . . 0.0 110.209 172.078 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 36.4 t -73.55 -64.16 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 CA-C-N 119.459 1.027 . . . . 0.0 112.01 179.07 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.01 -27.42 65.66 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.786 -0.571 . . . . 0.0 112.377 -174.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.67 -42.36 78.89 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 165.699 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -36.45 81.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.905 0.882 . . . . 0.0 111.736 175.557 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.4 mm -62.84 -22.11 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 120.861 -1.149 . . . . 0.0 111.429 175.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 t -83.79 -11.16 57.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 171.905 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -96.93 -60.03 1.68 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.522 -1.361 . . . . 0.0 112.099 -175.835 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -113.46 -17.47 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 N-CA-C 114.922 1.452 . . . . 0.0 114.922 -164.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.47 -83.87 0.26 Allowed Glycine 0 N--CA 1.465 0.632 0 C-N-CA 125.349 1.452 . . . . 0.0 111.171 167.615 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -161.3 -46.7 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.58 1.152 . . . . 0.0 112.333 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -96.97 -20.31 18.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.189 1.796 . . . . 0.0 114.472 -174.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -84.65 -11.26 56.29 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -167.627 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.31 163.03 23.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.178 1.791 . . . . 0.0 114.417 176.4 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -87.75 -172.41 3.85 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.77 1.628 . . . . 0.0 109.991 174.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -120.82 -19.22 7.4 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.038 1.335 . . . . 0.0 112.964 167.379 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.9 m -72.26 -53.41 12.57 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.401 1.08 . . . . 0.0 112.286 -173.415 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.2 -25.03 65.02 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 120.75 -1.219 . . . . 0.0 113.673 179.764 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.28 -58.89 4.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.517 0.727 . . . . 0.0 111.101 166.566 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.5 p -61.1 -25.62 67.09 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -177.121 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -69.06 -41.16 77.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.567 1.547 . . . . 0.0 113.082 171.569 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -89.73 -37.95 14.19 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.272 1.429 . . . . 0.0 112.879 -174.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -20.33 57.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.103 1.361 . . . . 0.0 113.172 171.028 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.21 58.91 2.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.833 1.253 . . . . 0.0 111.398 -177.717 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.0 pt -123.25 174.47 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 127.069 2.147 . . . . 0.0 110.185 174.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 51.7 m -70.36 141.29 52.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.643 1.577 . . . . 0.0 109.515 166.783 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.3 t -58.58 -39.39 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 O-C-N 121.426 -0.796 . . . . 0.0 111.057 179.442 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -70.52 -28.5 64.99 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -66.34 -39.52 89.28 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.125 -0.941 . . . . 0.0 110.786 168.796 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.65 72.22 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.251 0.932 . . . . 0.0 110.544 176.208 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -54.87 -37.73 66.63 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.088 1.355 . . . . 0.0 113.044 -179.143 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -86.51 -41.23 14.52 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 118.792 0.724 . . . . 0.0 112.732 174.695 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -61.33 -34.78 75.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.067 -1.02 . . . . 0.0 113.066 -177.787 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.0 mt -46.66 -62.75 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.134 1.374 . . . . 0.0 110.027 171.38 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -76.32 -19.11 58.56 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -179.417 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 . . . . . 0 CA--C 1.544 0.744 0 CA-C-N 118.832 0.742 . . . . 0.0 112.502 177.222 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.478 0.963 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.3 m120 53.9 26.39 6.19 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.252 1.821 . . . . 0.0 115.049 -174.568 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -8.61 40.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.495 1.118 . . . . 0.0 113.917 -178.514 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 p90 -70.37 7.31 1.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.931 2.092 . . . . 0.0 116.619 -168.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 -4.62 59.21 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.448 1.499 . . . . 0.0 114.796 -169.8 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.5 m -141.88 -46.53 0.36 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.02 1.728 . . . . 0.0 109.93 -167.147 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.6 169.8 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 123.637 0.775 . . . . 0.0 111.329 173.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 69.06 -14.29 0.31 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.051 2.14 . . . . 0.0 115.5 -174.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 13.43 2.2 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 178.339 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -146.54 38.14 1.02 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.226 1.01 . . . . 0.0 112.904 -173.334 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 . . . . . 0 CA--C 1.543 0.683 0 C-N-CA 124.792 1.237 . . . . 0.0 112.975 -168.05 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp . . . . . 0 CA--C 1.531 0.233 0 CA-C-O 121.636 0.731 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.6 p -126.46 -69.64 0.76 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.667 1.587 . . . . 0.0 112.378 174.786 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.89 -34.31 0.05 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -167.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -76.83 -13.98 59.95 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.568 0.747 . . . . 0.0 111.278 172.347 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 mp0 -86.87 -43.65 12.29 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.097 0.862 . . . . 0.0 112.719 -177.304 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.32 -32.9 74.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.153 -0.967 . . . . 0.0 112.367 178.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -64.5 -2.79 2.52 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 115.548 1.685 . . . . 0.0 115.548 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.8 mt -112.12 -17.4 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.734 1.613 . . . . 0.0 112.276 174.443 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 17.9 t -127.68 -53.14 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.187 0.903 . . . . 0.0 113.373 -172.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.82 -37.89 88.54 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.778 1.172 . . . . 0.0 110.845 171.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.95 -28.3 69.43 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.992 0.917 . . . . 0.0 113.054 170.749 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -37.84 59.24 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.307 1.043 . . . . 0.0 111.59 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.5 -33.78 55.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.937 -1.102 . . . . 0.0 110.773 170.327 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -72.57 -10.31 59.64 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 169.67 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -107.53 -42.72 4.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.499 1.499 . . . . 0.0 112.987 -172.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.0 m -127.99 -13.19 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -173.082 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -83.35 0.3 Allowed Glycine 0 N--CA 1.469 0.89 0 C-N-CA 124.931 1.253 . . . . 0.0 112.223 169.092 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.8 tt -167.85 -44.5 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.123 1.769 . . . . 0.0 111.01 -177.504 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -107.44 -10.57 15.71 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.174 1.79 . . . . 0.0 114.913 -168.987 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -89.2 -20.34 24.31 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -176.39 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.15 162.82 23.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.638 1.175 . . . . 0.0 112.116 166.48 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -120.73 174.24 6.71 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.526 1.155 . . . . 0.0 112.007 174.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.1 -23.95 35.43 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.906 1.282 . . . . 0.0 112.995 179.355 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.7 m -63.36 -51.4 66.09 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.252 1.421 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -64.33 -39.07 93.16 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.41 -0.806 . . . . 0.0 112.183 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.33 -51.03 71.5 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 168.537 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.5 p -60.14 -24.86 65.03 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.686 -1.259 . . . . 0.0 113.831 -178.529 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -87.15 -47.93 8.48 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.177 1.791 . . . . 0.0 111.922 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -90.24 -29.53 18.13 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.368 1.067 . . . . 0.0 113.39 -174.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.2 tp -93.99 -14.57 25.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.759 1.624 . . . . 0.0 112.785 178.623 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.16 66.59 0.94 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.307 1.843 . . . . 0.0 112.644 175.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 pt -142.94 167.56 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 127.263 2.225 . . . . 0.0 111.078 -179.059 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.407 HG22 ' H ' ' A' ' 69' ' ' ASP . 7.4 m -53.93 139.55 33.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.581 1.552 . . . . 0.0 110.813 164.487 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 t -58.31 -38.54 69.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 121.602 -0.686 . . . . 0.0 111.149 175.326 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.407 ' H ' HG22 ' A' ' 67' ' ' THR . 20.0 m-20 -72.9 -28.67 62.62 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.132 -0.98 . . . . 0.0 113.356 -179.978 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -66.57 -37.43 84.92 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.498 -0.763 . . . . 0.0 110.937 168.139 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.12 -47.49 73.96 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.843 0.747 . . . . 0.0 110.555 174.954 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -57.28 -38.85 74.57 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.24 1.016 . . . . 0.0 112.738 -179.544 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -89.6 -31.64 17.48 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -63.65 -38.04 89.61 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 120.585 -1.322 . . . . 0.0 112.138 176.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.9 mt -49.66 -56.67 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.143 0.977 . . . . 0.0 110.545 174.648 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -70.93 -35.76 72.37 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 179.106 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 . . . . . 0 N--CA 1.474 0.727 0 CA-C-N 119.348 0.976 . . . . 0.0 112.965 178.91 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 N--CA 1.477 0.894 0 CA-C-O 121.814 0.816 . . . . 0.0 112.523 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.89 25.14 15.11 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.922 2.089 . . . . 0.0 113.426 165.16 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -87.96 -10.05 51.68 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.414 1.485 . . . . 0.0 113.449 -173.942 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -76.05 15.47 0.55 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.679 2.392 . . . . 0.0 114.59 -176.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 32.4 pttt -83.34 -6.71 59.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.22 2.608 . . . . 0.0 114.191 -171.14 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 44.3 m -143.16 -54.54 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 126.586 1.955 . . . . 0.0 109.806 -172.486 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.5 pt -71.98 164.74 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.038 0.935 . . . . 0.0 111.91 177.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 -4.41 0.48 Allowed 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -178.617 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 44.3 mtm -97.83 -49.49 4.79 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.764 1.166 . . . . 0.0 113.627 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -107.26 -7.29 16.8 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -175.408 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.54 0.586 0 C-N-CA 125.127 1.371 . . . . 0.0 111.568 -174.1 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp . . . . . 0 CA--C 1.535 0.374 0 CA-C-O 121.536 0.684 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.6 m -116.7 -70.21 0.81 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.308 1.843 . . . . 0.0 112.68 -175.182 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -161.82 -41.21 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -171.682 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.1 -27.6 61.8 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.627 . . . . 0.0 110.866 174.198 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -72.91 -33.93 66.29 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.872 1.269 . . . . 0.0 110.803 -176.087 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -70.21 -34.5 72.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.879 0.871 . . . . 0.0 112.296 170.509 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -65.46 -3.73 4.77 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 171.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 mt -107.85 -53.89 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.772 1.629 . . . . 0.0 110.124 167.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.21 -62.85 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 124.194 0.998 . . . . 0.0 112.148 -174.431 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.93 66.88 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.593 0.757 . . . . 0.0 111.903 -177.113 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.12 -44.8 83.65 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.792 0.437 . . . . 0.0 111.945 164.738 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.03 -38.11 89.87 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.343 1.057 . . . . 0.0 112.47 174.806 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -62.6 -19.4 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.941 0.897 . . . . 0.0 111.632 176.182 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -88.18 -13.07 42.08 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.98 1.312 . . . . 0.0 114.26 172.305 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -96.82 -55.57 2.84 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.544 -1.348 . . . . 0.0 112.207 -175.14 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.9 m -118.64 -18.11 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -167.551 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.23 -85.79 0.32 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 125.775 1.655 . . . . 0.0 111.049 169.664 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.5 tp -167.04 -36.6 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.947 1.299 . . . . 0.0 112.919 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -104.53 -9.43 18.34 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.01 1.324 . . . . 0.0 114.035 -173.996 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -97.23 -14.74 21.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.568 1.147 . . . . 0.0 113.412 -175.82 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -70.59 164.33 25.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.071 1.348 . . . . 0.0 111.942 170.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -121.9 167.72 12.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.294 1.045 . . . . 0.0 112.114 174.182 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.08 -25.52 43.07 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.397 1.079 . . . . 0.0 112.668 -178.421 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.7 m -64.41 -45.49 87.35 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.67 1.588 . . . . 0.0 112.208 -179.113 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -65.52 -36.93 85.27 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.611 -1.305 . . . . 0.0 112.231 176.826 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.27 -49.24 72.62 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.4 0.68 . . . . 0.0 111.818 172.35 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.3 p -64.98 -25.69 67.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.046 0.938 . . . . 0.0 113.312 -179.083 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -76.11 -35.61 59.22 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.159 1.384 . . . . 0.0 112.712 177.11 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.6 mmm-85 -100.13 -32.77 10.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.981 1.312 . . . . 0.0 113.452 -172.397 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.3 mt -86.8 -19.31 29.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.103 1.361 . . . . 0.0 112.829 173.194 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.63 57.73 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.277 1.431 . . . . 0.0 112.072 -176.09 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.8 pt -120.28 167.4 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 127.747 2.419 . . . . 0.0 109.928 175.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.2 t -70.91 151.42 44.73 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.392 -0.817 . . . . 0.0 110.747 165.679 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.79 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.006 0.922 . . . . 0.0 111.262 -177.41 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -67.46 -32.63 73.62 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 179.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.77 -35.29 76.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.206 171.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.25 -47.39 67.9 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.809 0.731 . . . . 0.0 110.636 175.726 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -57.04 -41.96 79.62 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.231 1.412 . . . . 0.0 112.831 179.249 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 t -83.86 -34.08 24.68 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.173 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -65.71 -36.19 82.9 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.972 -1.08 . . . . 0.0 112.32 176.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.7 mt -51.13 -60.44 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.098 0.959 . . . . 0.0 109.841 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -54.14 -26.9 30.14 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 127.472 2.309 . . . . 0.0 115.802 174.422 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 . . . . . 0 CA--C 1.545 0.776 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 176.774 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 65.54 37.13 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 128.038 2.535 . . . . 0.0 111.868 166.002 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -78.29 -19.43 53.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.398 1.879 . . . . 0.0 114.942 -177.694 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -110.95 20.34 17.6 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.787 1.235 . . . . 0.0 112.78 -150.715 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -86.66 9.05 19.88 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 128.211 2.605 . . . . 0.0 114.721 -173.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.9 m -146.38 -49.32 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.439 1.895 . . . . 0.0 109.699 -169.327 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -80.86 155.38 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.411 1.485 . . . . 0.0 109.417 179.483 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? 64.04 14.19 8.3 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 126.011 1.724 . . . . 0.0 115.316 -178.6 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 20.9 mtm -115.48 -21.34 9.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 -178.048 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -129.27 -6.1 4.84 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -174.98 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 . . . . . 0 N--CA 1.477 0.879 0 C-N-CA 125.218 1.407 . . . . 0.0 113.018 -174.142 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 121.494 0.664 . . . . 0.0 110.747 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 62.6 m -115.88 -68.98 0.88 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.162 1.785 . . . . 0.0 112.27 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -163.82 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 123.452 0.701 . . . . 0.0 111.443 -171.004 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -68.56 -28.83 67.31 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.547 1.139 . . . . 0.0 110.264 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -72.81 -34.89 67.16 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.475 1.11 . . . . 0.0 112.062 178.667 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -70.4 -34.98 73.16 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.848 -1.158 . . . . 0.0 112.491 173.085 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -60.89 -6.32 1.76 Allowed 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 168.724 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.3 mt -108.13 -56.79 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.84 1.656 . . . . 0.0 110.342 169.419 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.1 t -69.18 -61.79 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 123.856 0.862 . . . . 0.0 111.373 -173.599 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.38 70.56 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.358 0.663 . . . . 0.0 111.829 -177.097 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.06 -44.61 87.56 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 122.889 0.475 . . . . 0.0 112.197 167.681 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -36.75 80.92 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.992 0.917 . . . . 0.0 112.257 175.329 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.1 mm -60.56 -28.32 42.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.772 -1.205 . . . . 0.0 110.655 175.664 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -77.14 -14.75 59.74 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 173.074 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -93.74 -54.28 3.69 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.398 -1.439 . . . . 0.0 112.115 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.3 m -118.63 -13.17 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -164.709 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.7 -77.31 0.4 Allowed Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.365 1.46 . . . . 0.0 112.106 166.438 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.9 tp -163.66 -43.5 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.321 1.449 . . . . 0.0 111.854 170.758 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -108.96 -5.6 16.03 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -167.606 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -89.7 -17.71 27.82 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.037 0.935 . . . . 0.0 112.993 -176.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.36 164.46 9.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.802 1.241 . . . . 0.0 112.528 165.863 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -110.36 167.01 10.52 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 122.292 1.044 . . . . 0.0 111.466 171.423 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.04 -24.25 37.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.145 0.978 . . . . 0.0 112.412 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.39 -45.25 93.96 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.192 1.797 . . . . 0.0 112.519 -179.49 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -65.26 -41.82 93.88 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.639 -1.288 . . . . 0.0 111.989 176.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.52 -46.06 90.13 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.657 -0.652 . . . . 0.0 111.912 174.235 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.7 p -65.37 -23.47 66.98 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.182 -0.949 . . . . 0.0 113.402 179.366 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.03 1.332 . . . . 0.0 112.389 176.253 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -102.74 -40.22 6.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.363 1.465 . . . . 0.0 113.072 -169.944 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.4 mp -81.03 -17.77 49.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.606 1.162 . . . . 0.0 113.207 170.304 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.92 58.24 2.83 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-O 122.693 1.235 . . . . 0.0 111.49 -175.282 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.1 pt -122.79 164.56 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 128.011 2.524 . . . . 0.0 109.532 177.024 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 t -70.64 153.49 42.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 121.243 -0.91 . . . . 0.0 110.766 167.568 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -58.3 -37.69 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.869 0.868 . . . . 0.0 111.167 -177.366 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.62 -29.99 68.62 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 179.396 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -67.3 -38.36 84.85 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.096 170.338 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.66 -48.12 67.56 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.632 0.651 . . . . 0.0 110.329 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -56.47 -32.41 64.94 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.95 1.7 . . . . 0.0 113.987 178.751 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -90.25 -42.05 11.22 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.968 0.804 . . . . 0.0 112.822 173.454 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.6 -35.77 72.96 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.899 -1.126 . . . . 0.0 113.333 -178.393 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.6 mt -50.37 -42.47 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 0.0 112.25 174.231 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -94.59 -25.76 16.66 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 176.396 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 . . . . . 0 CA--C 1.543 0.687 0 CA-C-N 118.819 0.736 . . . . 0.0 112.952 -179.724 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 41.1 p . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 123.247 1.499 . . . . 0.0 113.332 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -84.58 -8.0 59.06 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.457 2.303 . . . . 0.0 112.002 -173.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.4 -17.59 59.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 128.389 2.676 . . . . 0.0 113.163 176.666 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -71.52 15.69 0.13 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.015 2.126 . . . . 0.0 115.81 -174.709 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' A' ' 88' ' ' LYS . 31.6 mtmt -66.82 100.12 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.318 -1.489 . . . . 0.0 109.573 -176.085 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 75.79 2.58 3.72 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.385 2.674 . . . . 0.0 114.827 -176.623 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.2 mt -117.66 145.72 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.898 1.279 . . . . 0.0 109.993 -175.464 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 60.52 14.27 4.75 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.643 1.577 . . . . 0.0 114.344 -169.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.7 ptm -138.01 9.69 2.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.984 1.713 . . . . 0.0 114.02 -178.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -145.69 -36.05 0.29 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.03 1.492 . . . . 0.0 115.03 -163.099 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 . . . . . 0 N--CA 1.474 0.738 0 O-C-N 121.355 -0.84 . . . . 0.0 112.9 -175.266 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp . . . . . 0 CA--C 1.532 0.279 0 CA-C-O 121.424 0.63 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -93.08 -78.41 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 125.489 1.516 . . . . 0.0 111.188 170.231 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -156.56 -46.13 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 122.971 0.508 . . . . 0.0 111.156 -172.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -65.83 -29.72 70.23 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.438 0.695 . . . . 0.0 111.683 175.542 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -73.63 -45.9 50.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.954 0.901 . . . . 0.0 111.866 -169.273 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -67.12 -28.14 67.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.221 1.009 . . . . 0.0 112.63 169.926 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -69.74 -1.74 10.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.803 1.241 . . . . 0.0 114.087 170.045 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -106.54 -53.76 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.149 1.38 . . . . 0.0 109.932 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.5 t -72.39 -59.15 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.092 0.86 . . . . 0.0 112.066 -174.694 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.87 64.48 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.495 0.589 . . . . 0.0 112.294 -177.41 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.18 -44.56 94.96 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.661 -0.65 . . . . 0.0 112.392 164.633 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.93 -34.31 77.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.053 0.842 . . . . 0.0 111.945 175.582 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -61.52 -22.66 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 O-C-N 120.559 -1.338 . . . . 0.0 112.023 174.154 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 t -83.63 -12.79 55.53 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.557 1.143 . . . . 0.0 114.065 171.952 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -93.41 -56.37 2.96 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.635 -1.291 . . . . 0.0 112.284 -175.607 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.3 m -122.94 -17.23 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 -165.611 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 130.45 -89.08 0.3 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 125.758 1.647 . . . . 0.0 110.413 172.711 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 54.3 tp -163.72 -36.33 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.101 1.36 . . . . 0.0 113.066 177.921 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -107.68 -2.66 19.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -173.287 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -94.91 -17.84 21.66 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.241 1.016 . . . . 0.0 112.955 178.771 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -73.43 164.41 26.7 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.336 1.454 . . . . 0.0 111.924 169.634 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.9 p30 -115.39 172.61 6.99 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.194 0.997 . . . . 0.0 111.653 170.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.79 -21.36 29.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.427 1.091 . . . . 0.0 112.611 178.571 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.0 m -63.25 -50.19 71.16 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.892 1.677 . . . . 0.0 111.643 -178.346 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -66.37 -45.53 79.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.829 -1.169 . . . . 0.0 112.276 -179.296 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -52.29 -54.31 32.96 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.504 1.122 . . . . 0.0 112.241 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.4 p -66.88 -27.99 67.96 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -177.599 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -70.8 -46.76 62.25 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.086 1.355 . . . . 0.0 112.637 173.324 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 66.1 mtt85 -78.46 -40.61 35.12 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.21 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -85.45 -19.01 31.92 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.395 1.478 . . . . 0.0 111.747 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.23 66.52 0.71 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.0 1.72 . . . . 0.0 111.92 179.069 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -132.37 172.75 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 127.004 2.121 . . . . 0.0 110.956 178.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 55.0 m -66.05 137.72 57.28 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.226 1.41 . . . . 0.0 109.05 165.625 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.7 t -57.41 -38.97 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 O-C-N 121.716 -0.615 . . . . 0.0 110.984 -179.131 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.87 -26.53 64.24 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.815 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -66.78 -39.49 87.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.566 -0.73 . . . . 0.0 111.268 169.526 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.53 -45.72 74.91 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.901 0.773 . . . . 0.0 110.299 175.031 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -54.79 -42.24 71.52 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.765 1.226 . . . . 0.0 112.608 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -83.4 -38.06 22.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 176.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.62 -33.75 75.63 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.067 -1.021 . . . . 0.0 113.277 -178.503 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -49.13 -47.0 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.988 1.315 . . . . 0.0 111.418 172.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -87.32 -26.88 23.17 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 175.694 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 . . . . . 0 CA--C 1.543 0.694 0 CA-C-N 119.192 0.906 . . . . 0.0 112.632 -179.29 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 72.3 p . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 57.3 40.56 27.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.739 1.615 . . . . 0.0 111.616 -171.676 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -82.05 -19.07 41.04 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.536 1.535 . . . . 0.0 114.865 -174.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -116.06 10.61 15.09 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -141.824 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -85.12 -6.53 59.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.354 1.862 . . . . 0.0 115.02 -167.53 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.1 m -144.45 -46.39 0.25 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.709 1.603 . . . . 0.0 110.993 -164.094 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.2 pt -75.93 174.37 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.044 1.338 . . . . 0.0 111.889 175.128 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 65.21 -15.69 0.1 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 127.18 2.192 . . . . 0.0 116.16 -175.039 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.0 ptm -123.85 1.13 8.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.708 1.603 . . . . 0.0 114.241 -176.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -134.2 -9.59 2.6 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -166.13 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 . . . . . 0 N--CA 1.472 0.635 0 C-N-CA 124.849 1.26 . . . . 0.0 110.813 -173.76 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 CA--C 1.535 0.385 0 CA-C-O 121.851 0.834 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.4 t -112.86 -77.22 0.58 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 127.42 2.288 . . . . 0.0 111.544 179.53 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -155.7 -40.98 0.08 Allowed 'General case' 0 C--N 1.327 -0.41 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -67.7 -28.76 67.95 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.546 0.739 . . . . 0.0 111.008 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.6 mp0 -71.84 -32.4 67.49 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.812 -0.555 . . . . 0.0 112.35 179.574 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mttt -70.08 -34.84 73.68 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 120.889 -1.132 . . . . 0.0 112.779 170.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -64.46 0.48 1.04 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 169.115 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -112.54 -52.2 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 126.531 1.932 . . . . 0.0 110.924 167.492 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 64.0 t -74.05 -59.97 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.905 0.775 . . . . 0.0 112.275 -175.061 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.05 -28.78 68.49 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.35 -11.32 40.92 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 167.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.04 -36.88 11.36 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.212 1.405 . . . . 0.0 111.299 167.132 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.7 mm -63.72 -27.55 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 O-C-N 120.518 -1.364 . . . . 0.0 112.027 178.915 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.0 p -68.43 -19.83 64.61 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 168.336 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -106.96 -42.06 5.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.173 0.897 . . . . 0.0 113.168 -157.526 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -128.03 -14.67 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.76 -93.33 0.29 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 125.821 1.677 . . . . 0.0 110.173 173.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -164.0 -28.78 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.636 1.574 . . . . 0.0 113.372 175.666 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -108.35 -12.91 14.98 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 114.603 -172.007 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -91.89 -20.18 21.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.121 0.968 . . . . 0.0 112.938 -175.857 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.0 pp -67.87 164.0 20.7 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.637 1.575 . . . . 0.0 112.187 166.62 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.06 171.25 7.78 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.374 1.083 . . . . 0.0 111.946 172.276 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -20.75 32.37 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.102 1.361 . . . . 0.0 113.005 -179.166 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.9 m -67.74 -46.99 70.55 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.835 1.654 . . . . 0.0 111.807 -178.564 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -65.8 -45.13 83.52 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.114 -0.991 . . . . 0.0 112.041 178.769 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -52.48 -56.34 15.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.085 0.554 . . . . 0.0 112.103 168.969 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.8 p -64.69 -21.84 66.84 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.235 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -74.03 -48.66 28.51 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.591 1.557 . . . . 0.0 112.187 173.377 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -76.11 -39.42 55.24 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.89 0.876 . . . . 0.0 112.636 179.762 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.3 mt -81.72 -21.99 37.61 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.094 1.357 . . . . 0.0 113.164 -179.125 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.65 58.5 2.85 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.335 1.454 . . . . 0.0 111.991 -176.764 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.4 pt -123.71 178.44 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 127.68 2.392 . . . . 0.0 109.644 175.358 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -76.59 147.88 37.34 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.494 -0.754 . . . . 0.0 110.843 164.438 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.2 t -53.76 -35.13 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.109 1.363 . . . . 0.0 110.982 175.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.25 -24.22 62.13 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 -176.205 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -78.19 -37.4 45.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.081 0.855 . . . . 0.0 111.253 168.934 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.28 -47.85 75.24 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.701 0.682 . . . . 0.0 110.132 -179.094 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -64.43 -30.78 71.81 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -175.448 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -89.99 -33.25 16.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.906 0.776 . . . . 0.0 112.709 174.899 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.09 -37.09 85.81 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.067 -1.021 . . . . 0.0 112.483 177.772 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -50.32 -63.12 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.361 1.064 . . . . 0.0 110.22 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -63.63 -29.76 70.96 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -179.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 . . . . . 0 CA--C 1.544 0.738 0 CA-C-N 119.065 0.848 . . . . 0.0 112.885 174.722 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.6 p . . . . . 0 N--CA 1.478 0.933 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 46.95 34.14 2.57 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 126.467 1.907 . . . . 0.0 113.564 -167.254 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.4 -9.01 19.76 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -177.475 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -71.48 14.87 0.15 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 127.074 2.149 . . . . 0.0 115.516 -172.805 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -92.23 -4.55 53.93 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.982 2.513 . . . . 0.0 115.048 -166.025 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 57.2 m -145.77 -46.12 0.21 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.103 1.761 . . . . 0.0 110.475 -168.544 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.4 pt -64.65 167.16 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.57 1.148 . . . . 0.0 111.575 173.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 67.07 -9.9 0.35 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 126.496 1.919 . . . . 0.0 115.928 -176.669 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -143.59 19.65 1.85 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.659 1.118 . . . . 0.0 113.792 -176.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -152.49 -40.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.424 1.089 . . . . 0.0 112.921 -176.144 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 124.847 1.259 . . . . 0.0 112.699 175.742 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 mp . . . . . 0 C--O 1.234 0.264 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 85.1 p -97.76 -71.4 0.69 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.641 1.176 . . . . 0.0 111.667 169.026 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -163.67 -34.31 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 124.575 1.15 . . . . 0.0 111.666 -168.354 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.83 -32.81 46.32 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.819 -0.55 . . . . 0.0 111.705 173.742 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -75.09 -39.16 60.94 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.174 -0.954 . . . . 0.0 112.527 -170.077 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -67.66 -28.51 67.76 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.27 -0.894 . . . . 0.0 112.406 172.787 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -67.5 -6.88 21.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 168.476 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -101.56 -39.72 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.012 1.325 . . . . 0.0 111.052 170.825 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.6 t -90.48 -54.15 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 119.059 0.845 . . . . 0.0 113.141 -174.563 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.14 -35.66 81.5 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.104 0.865 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.26 -33.43 71.03 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.22 -38.09 60.83 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.095 -1.003 . . . . 0.0 111.767 176.442 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -61.84 -26.99 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 120.858 -1.151 . . . . 0.0 111.229 173.009 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.4 m -79.51 -12.13 59.88 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 170.187 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.7 -39.5 6.32 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.622 1.101 . . . . 0.0 112.821 -172.462 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -132.64 -15.53 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -171.58 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.37 -82.1 0.34 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 125.417 1.484 . . . . 0.0 111.62 171.377 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 35.6 tp -171.66 -34.51 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.471 1.908 . . . . 0.0 111.236 177.026 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -107.69 -5.59 17.33 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -167.05 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -99.09 -22.46 15.68 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -62.65 157.94 19.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.917 1.287 . . . . 0.0 112.612 171.02 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.56 172.67 6.78 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.493 1.139 . . . . 0.0 112.094 177.617 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -18.55 30.27 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.988 1.315 . . . . 0.0 112.739 -179.058 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.7 m -66.5 -50.24 63.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.689 1.596 . . . . 0.0 111.417 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -65.92 -45.37 82.14 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.964 -1.085 . . . . 0.0 111.973 179.813 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mp -53.25 -52.73 58.06 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.763 0.825 . . . . 0.0 112.862 170.035 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.7 p -63.6 -28.22 69.78 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 120.738 -1.226 . . . . 0.0 113.669 -179.351 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -75.81 -44.24 42.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.3 1.44 . . . . 0.0 112.783 177.312 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.6 mmt-85 -86.89 -39.21 16.02 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.586 1.154 . . . . 0.0 113.742 -176.557 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -85.06 -17.74 36.49 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.691 1.597 . . . . 0.0 111.663 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 61.66 64.14 1.07 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.978 1.711 . . . . 0.0 111.825 178.892 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 16.0 pt -132.53 162.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 127.547 2.339 . . . . 0.0 109.104 178.502 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.1 t -68.35 149.92 48.81 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.495 -0.753 . . . . 0.0 110.338 166.87 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.4 t -57.43 -34.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.987 0.915 . . . . 0.0 111.078 -177.853 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.35 -33.12 73.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 178.781 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -67.72 -35.44 78.77 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.915 0.78 . . . . 0.0 111.181 171.317 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.82 -48.78 62.7 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.796 0.726 . . . . 0.0 110.615 176.421 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -57.81 -32.11 67.24 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.564 1.546 . . . . 0.0 113.665 179.051 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.1 t -89.71 -43.18 10.88 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.024 0.829 . . . . 0.0 113.003 174.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -58.75 -36.95 75.18 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.76 1.164 . . . . 0.0 113.129 -177.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mt -48.96 -48.09 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 125.063 1.345 . . . . 0.0 111.731 173.884 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -91.66 -25.34 19.18 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 179.438 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 . . . . . 0 CA--C 1.544 0.716 0 CA-C-N 119.397 0.999 . . . . 0.0 112.38 179.493 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.6 m . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -153.11 28.09 0.52 Allowed 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.418 168.935 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -111.85 33.58 4.71 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.979 1.712 . . . . 0.0 111.967 -172.511 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -124.99 17.52 8.52 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.764 1.626 . . . . 0.0 113.21 -173.808 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -76.82 -6.17 51.23 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.107 2.163 . . . . 0.0 115.873 -175.593 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.0 t -137.17 -38.63 0.61 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.434 1.494 . . . . 0.0 112.137 177.146 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.1 mt -63.23 157.85 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.299 1.44 . . . . 0.0 109.178 167.615 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.5 -24.2 0.06 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 127.321 2.248 . . . . 0.0 116.858 -177.29 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -101.83 -25.71 13.72 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.122 1.369 . . . . 0.0 114.439 175.894 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.08 -4.68 59.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 171.387 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 . . . . . 0 CA--C 1.544 0.726 0 C-N-CA 125.513 1.525 . . . . 0.0 112.077 -178.961 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.547 0.842 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 t -76.96 -79.56 0.11 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.503 1.121 . . . . 0.0 112.886 -173.39 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.47 -44.06 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.579 0.752 . . . . 0.0 111.403 -170.754 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -72.57 -28.34 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.027 0.531 . . . . 0.0 111.08 171.797 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -72.36 -49.73 32.01 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.448 1.099 . . . . 0.0 112.043 -171.167 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -65.37 -25.47 67.58 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.304 -1.497 . . . . 0.0 113.481 172.188 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -66.95 -5.54 13.12 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 167.478 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.31 -52.68 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.121 1.368 . . . . 0.0 110.043 167.153 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.8 t -79.41 -51.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.039 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.41 -32.95 74.18 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 118.982 0.81 . . . . 0.0 110.948 179.065 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.03 -36.35 74.82 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 167.773 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -40.67 70.34 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.123 -0.986 . . . . 0.0 111.776 175.72 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.2 -31.16 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 O-C-N 120.86 -1.15 . . . . 0.0 111.133 172.233 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -72.79 -17.23 61.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 171.693 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -102.49 -42.72 5.86 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.725 -1.234 . . . . 0.0 112.641 -170.665 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.98 -12.86 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -171.871 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.21 -82.54 0.34 Allowed Glycine 0 N--CA 1.469 0.852 0 C-N-CA 125.389 1.471 . . . . 0.0 112.59 167.095 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 65.5 tp -167.64 -36.27 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.263 1.825 . . . . 0.0 111.666 -179.117 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -112.29 -10.14 13.83 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.189 1.396 . . . . 0.0 114.645 -167.475 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -93.43 -15.31 25.75 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.158 0.983 . . . . 0.0 112.886 179.233 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -71.78 164.92 25.11 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.23 1.412 . . . . 0.0 113.533 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -110.13 118.63 36.9 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.637 1.175 . . . . 0.0 111.626 -179.501 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.7 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.639 1.176 . . . . 0.0 113.389 176.501 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.8 m -69.43 -41.38 76.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.313 -0.867 . . . . 0.0 111.543 173.543 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -61.3 -41.26 96.69 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.796 -1.19 . . . . 0.0 111.736 172.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.87 -46.32 81.89 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.675 -0.64 . . . . 0.0 111.795 168.787 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.1 p -60.59 -22.41 63.68 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.516 -1.365 . . . . 0.0 113.887 178.821 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -94.66 -43.04 8.46 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.114 1.766 . . . . 0.0 112.064 -175.492 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.4 mmt85 -79.22 -37.61 37.69 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.249 1.419 . . . . 0.0 112.835 176.872 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tp -98.88 -12.02 21.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.956 1.702 . . . . 0.0 113.544 -173.064 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.76 55.62 4.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.116 1.367 . . . . 0.0 112.643 176.218 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 10.1 pt -123.23 163.98 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 126.971 2.108 . . . . 0.0 110.731 174.913 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 58.8 m -57.88 139.44 54.2 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.711 1.204 . . . . 0.0 110.394 163.149 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -61.22 -33.82 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 O-C-N 121.116 -0.99 . . . . 0.0 111.642 -179.547 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -72.76 -31.98 65.29 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.34 -0.85 . . . . 0.0 112.946 176.281 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.27 -39.56 94.92 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.683 167.121 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.18 -49.78 72.91 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.147 0.885 . . . . 0.0 110.896 178.745 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -33.95 73.38 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -179.737 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -86.12 -40.52 15.6 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.348 0.976 . . . . 0.0 112.825 175.689 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.45 -37.39 75.33 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.974 1.31 . . . . 0.0 113.056 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.3 mt -49.05 -39.8 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.953 1.301 . . . . 0.0 111.708 171.785 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -90.25 -32.5 16.53 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.718 1.207 . . . . 0.0 113.531 178.333 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 m120 . . . . . 0 CA--C 1.543 0.703 0 CA-C-N 118.688 0.676 . . . . 0.0 111.842 -176.633 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 62.4 p . . . . . 0 N--CA 1.482 1.158 0 N-CA-C 113.461 0.912 . . . . 0.0 113.461 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 61.29 19.36 10.07 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.836 1.654 . . . . 0.0 113.451 -176.045 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -82.08 -13.22 57.61 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.583 1.953 . . . . 0.0 113.974 -178.483 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -74.17 14.71 0.39 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.642 1.977 . . . . 0.0 114.83 -172.097 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -80.24 -19.12 47.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.397 1.479 . . . . 0.0 112.974 -170.79 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.3 m -122.72 -39.07 2.56 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.599 1.96 . . . . 0.0 111.477 -172.834 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.4 mt -67.27 158.82 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.559 1.144 . . . . 0.0 108.415 165.131 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.6 ttmm 67.51 -10.58 0.35 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 167.644 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.3 ptt? -83.6 -26.37 30.06 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.113 0.869 . . . . 0.0 113.162 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 p90 -121.57 -10.83 8.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.844 1.258 . . . . 0.0 114.359 -175.172 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 . . . . . 0 CA--C 1.541 0.599 0 C-N-CA 124.64 1.176 . . . . 0.0 111.788 -176.871 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.524 0 N-CA-C 111.17 -0.772 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 58.9 p -149.5 160.01 43.82 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.487 1.515 . . . . 0.0 112.117 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 32.8 t60 -101.01 123.95 45.98 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.39 1.076 . . . . 0.0 110.97 175.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 90.8 mtp -134.49 110.96 9.72 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.002 1.321 . . . . 0.0 109.923 177.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -134.49 -58.41 0.83 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.059 1.343 . . . . 0.0 112.189 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.4 m 51.03 32.28 7.41 Favored 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 174.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 mmt -146.46 -44.86 0.19 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.369 1.867 . . . . 0.0 112.371 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.2 m-20 -88.4 0.1 56.6 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.472 1.509 . . . . 0.0 112.891 -177.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.24 28.23 1.7 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.551 1.14 . . . . 0.0 113.297 -164.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -100.87 69.59 1.35 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.954 1.301 . . . . 0.0 110.771 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -139.44 -50.19 0.5 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.212 1.005 . . . . 0.0 113.288 177.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -126.65 122.71 35.76 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.164 1.386 . . . . 0.0 109.568 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.9 mm -133.48 122.2 43.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.604 1.562 . . . . 0.0 108.928 -171.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.5 tt -149.06 147.3 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 124.95 1.3 . . . . 0.0 111.646 -174.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -102.63 -27.79 12.53 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -173.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -142.62 137.69 30.2 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.886 1.274 . . . . 0.0 111.709 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 25.7 pt -133.14 4.95 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.671 1.188 . . . . 0.0 114.189 -174.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.4 pm0 -144.84 165.98 26.55 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.485 1.514 . . . . 0.0 112.38 -177.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -82.6 12.66 4.39 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.01 1.724 . . . . 0.0 114.97 -172.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -138.42 152.01 47.98 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 126.911 2.084 . . . . 0.0 110.755 178.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -147.87 -82.97 0.12 Allowed 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.601 1.16 . . . . 0.0 111.94 175.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.2 mp -127.73 6.42 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 126.485 1.914 . . . . 0.0 112.199 -176.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -92.88 2.46 56.76 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.634 -1.291 . . . . 0.0 114.003 -171.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.0 t -125.79 -44.78 1.78 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.847 1.259 . . . . 0.0 112.898 -174.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.6 p-10 -71.29 -26.97 63.09 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.004 1.321 . . . . 0.0 114.501 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.5 t -90.25 -31.27 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 125.022 1.329 . . . . 0.0 111.544 175.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.0 t -132.04 85.47 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 125.202 1.401 . . . . 0.0 110.204 -175.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.6 tp -110.41 138.02 47.34 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.861 1.264 . . . . 0.0 111.897 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -137.4 38.62 2.48 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 126.024 1.73 . . . . 0.0 112.586 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -128.07 56.16 19.92 Favored Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 124.686 1.195 . . . . 0.0 113.341 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -77.39 74.64 5.02 Favored 'Trans proline' 0 CA--C 1.545 1.068 0 C-N-CA 123.749 2.966 . . . . 0.0 111.598 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 34.8 mmt-85 -124.6 -54.3 1.66 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.02 1.328 . . . . 0.0 113.82 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.8 t -136.75 88.86 18.45 Favored Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 124.426 1.09 . . . . 0.0 110.599 -173.046 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.09 155.77 26.05 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.729 2.286 . . . . 0.0 113.317 176.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.1 p -85.92 56.07 3.81 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 127.461 2.304 . . . . 0.0 113.652 -171.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -83.51 16.88 2.39 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 115.97 1.841 . . . . 0.0 115.97 -171.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -90.99 69.37 6.29 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.984 1.714 . . . . 0.0 111.837 -166.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.4 t -132.34 34.84 3.71 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.118 1.367 . . . . 0.0 113.25 -172.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 78.75 45.72 9.13 Favored Glycine 0 CA--C 1.535 1.309 0 O-C-N 120.763 -1.211 . . . . 0.0 113.474 179.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -99.47 35.99 1.85 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.307 1.843 . . . . 0.0 112.599 -168.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 64.27 99.26 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 128.076 2.551 . . . . 0.0 113.752 175.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.9 m -93.17 -73.13 0.57 Allowed 'General case' 0 N--CA 1.474 0.768 0 O-C-N 121.186 -0.946 . . . . 0.0 113.061 -168.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -162.61 -45.68 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 122.939 0.496 . . . . 0.0 111.432 -174.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -66.77 -33.89 76.61 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.641 0.777 . . . . 0.0 110.577 174.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -68.0 -38.75 83.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.602 1.161 . . . . 0.0 111.375 -176.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.3 mtmt -64.89 -37.76 88.7 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 172.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -66.12 -2.42 4.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 114.341 1.237 . . . . 0.0 114.341 171.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.6 mt -105.21 -53.29 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.104 1.362 . . . . 0.0 110.432 165.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.3 t -69.96 -64.06 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 CA-C-N 119.059 0.845 . . . . 0.0 111.817 -173.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.62 -30.74 68.55 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.147 0.579 . . . . 0.0 111.704 -174.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -55.87 -36.93 68.14 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 166.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.34 -37.9 60.45 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.241 1.016 . . . . 0.0 112.311 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.3 mm -61.5 -30.96 49.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 O-C-N 121.044 -1.035 . . . . 0.0 110.501 175.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.3 t -72.81 -17.0 61.6 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.91 1.284 . . . . 0.0 114.286 171.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -101.38 -42.66 6.2 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.601 -1.312 . . . . 0.0 112.745 -169.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.6 m -129.04 -13.31 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 115.231 1.567 . . . . 0.0 115.231 -169.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.88 -78.26 0.38 Allowed Glycine 0 N--CA 1.47 0.915 0 C-N-CA 125.187 1.375 . . . . 0.0 112.198 165.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tp -160.6 -45.87 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.592 1.157 . . . . 0.0 112.287 174.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -109.74 -8.28 14.95 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 125.801 1.64 . . . . 0.0 114.28 -167.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -88.72 -14.29 37.59 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.873 0.869 . . . . 0.0 112.852 -175.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -66.52 166.67 12.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.724 1.21 . . . . 0.0 112.082 164.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 18.1 p30 -119.09 165.16 14.5 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 122.427 1.108 . . . . 0.0 111.716 170.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.89 -26.78 59.91 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.551 1.14 . . . . 0.0 112.679 -178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -65.38 -46.06 81.56 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 125.926 1.69 . . . . 0.0 112.123 -179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -67.37 -27.92 67.52 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 120.578 -1.326 . . . . 0.0 113.088 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -69.37 -56.92 6.07 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.201 1.0 . . . . 0.0 111.695 167.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.2 p -60.3 -26.68 66.7 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.565 1.146 . . . . 0.0 113.703 -177.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -70.37 -27.41 64.3 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 125.12 1.368 . . . . 0.0 113.74 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.0 mtt85 -114.08 -31.57 6.31 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.753 1.221 . . . . 0.0 113.454 -174.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 79.3 mt -84.69 -19.03 33.45 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.413 1.485 . . . . 0.0 112.723 173.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 60.53 22.38 12.09 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 126.166 1.786 . . . . 0.0 114.164 -178.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.5 pt -73.64 164.84 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 125.963 1.705 . . . . 0.0 110.538 163.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.405 HG23 ' H ' ' A' ' 70' ' ' LYS . 15.3 t -76.34 156.8 33.01 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 121.512 -0.742 . . . . 0.0 110.946 166.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.09 -38.37 73.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.01 0.924 . . . . 0.0 111.487 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -70.08 -31.39 68.96 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.405 ' H ' HG23 ' A' ' 67' ' ' THR . 77.6 mttt -67.93 -36.67 80.55 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 118.011 -0.995 . . . . 0.0 111.076 168.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.05 -47.33 71.68 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.445 1.02 . . . . 0.0 111.196 177.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 46.9 mtpt -55.3 -43.38 74.77 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.536 1.534 . . . . 0.0 112.631 177.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -82.5 -38.23 24.14 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.8 -39.3 73.88 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 120.866 -1.146 . . . . 0.0 112.59 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.9 mt -48.94 -65.98 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.338 1.455 . . . . 0.0 110.453 173.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -64.91 -27.14 68.65 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.311 1.226 . . . . 0.0 114.311 176.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -73.35 -36.67 66.17 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.463 1.029 . . . . 0.0 112.841 -177.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 35.7 m -80.05 -39.13 30.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.953 0.901 . . . . 0.0 112.899 171.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.81 88.75 1.63 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.379 1.072 . . . . 0.0 111.458 -175.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -73.81 -42.96 60.2 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.049 0.94 . . . . 0.0 113.299 178.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 24.5 mmt -102.62 -19.93 14.63 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.214 1.406 . . . . 0.0 113.576 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.63 133.76 4.66 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 124.299 0.952 . . . . 0.0 110.865 -168.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 46.84 36.05 3.64 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.643 1.577 . . . . 0.0 113.665 -177.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 47.43 33.25 2.67 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 127.382 2.273 . . . . 0.0 113.768 -176.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.4 4.93 0.38 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.688 1.995 . . . . 0.0 115.575 -172.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -79.57 -10.84 59.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 120.145 -1.597 . . . . 0.0 113.647 -173.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.0 p90 -68.03 9.25 0.32 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.12 2.168 . . . . 0.0 115.352 -176.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -92.01 -6.0 51.94 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 128.611 2.764 . . . . 0.0 114.234 -172.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.2 m -141.47 -45.66 0.37 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.138 1.775 . . . . 0.0 110.489 -170.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 26.0 pt -64.09 168.12 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 123.689 0.796 . . . . 0.0 111.193 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? 69.06 -14.94 0.28 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 126.694 1.998 . . . . 0.0 116.241 -177.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.39 19.72 2.39 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 120.414 1.461 . . . . 0.0 114.777 176.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 t80 -142.94 -24.58 0.62 Allowed 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 115.169 1.544 . . . . 0.0 115.169 -176.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -83.13 130.17 35.09 Favored 'General case' 0 CA--C 1.542 0.673 0 O-C-N 121.228 -0.92 . . . . 0.0 111.728 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -147.58 155.35 41.75 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.671 1.588 . . . . 0.0 111.61 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -74.85 145.56 42.69 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.049 0.94 . . . . 0.0 112.007 172.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.4 t -123.2 -47.11 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 124.734 1.214 . . . . 0.0 111.512 177.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.2 m -125.82 25.98 6.74 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.378 1.471 . . . . 0.0 112.685 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . 0.256 85.8 p 47.92 35.02 4.45 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 127.0 2.12 . . . . 0.0 115.348 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -138.44 158.02 45.07 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.08 1.752 . . . . 0.0 112.292 -176.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 69.1 m -144.67 141.1 29.08 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 125.422 1.489 . . . . 0.0 110.689 -175.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.85 15.5 1.15 Allowed 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 125.889 1.676 . . . . 0.0 115.367 -175.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.1 mm-40 -82.03 153.3 69.45 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.889 1.276 . . . . 0.0 111.707 176.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -65.71 115.0 3.16 Favored 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 123.11 2.54 . . . . 0.0 111.224 176.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -139.88 91.68 2.49 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.877 1.671 . . . . 0.0 109.6 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.55 91.0 35.58 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 125.08 1.352 . . . . 0.0 109.518 -175.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 C--O 1.253 1.236 0 C-N-CA 123.963 3.109 . . . . 0.0 113.4 -176.237 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.504 0 N-CA-C 111.105 -0.798 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 52.3 m -120.24 151.81 38.64 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.258 1.423 . . . . 0.0 112.132 -178.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -111.37 32.84 5.06 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.241 1.416 . . . . 0.0 112.896 -172.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 67.0 mtt -86.38 79.12 9.12 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 125.166 1.386 . . . . 0.0 110.869 -176.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -122.1 -70.92 0.75 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.931 1.293 . . . . 0.0 112.549 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 16.6 m 53.26 25.38 4.36 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 117.056 2.243 . . . . 0.0 117.056 171.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.7 mtm -146.8 -33.17 0.3 Allowed 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.839 1.256 . . . . 0.0 114.316 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -94.66 -2.41 51.33 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.663 1.585 . . . . 0.0 113.143 -174.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.44 38.08 1.25 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.101 1.36 . . . . 0.0 112.038 -162.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.8 mp -104.73 40.2 1.54 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.505 1.522 . . . . 0.0 112.037 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -143.05 99.48 3.46 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.829 1.652 . . . . 0.0 107.927 174.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -83.42 106.63 15.33 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.549 1.14 . . . . 0.0 111.107 -176.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.6 mp -98.78 75.32 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 124.018 0.927 . . . . 0.0 111.091 -171.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 15.6 tt -147.97 150.24 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.514 1.126 . . . . 0.0 111.971 175.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -147.56 -38.34 0.2 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.697 1.199 . . . . 0.0 112.613 175.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.411 ' HG2' ' H ' ' A' ' 11' ' ' ILE . 9.6 tt0 -138.57 179.54 6.41 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.642 1.577 . . . . 0.0 111.201 175.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.411 ' H ' ' HG2' ' A' ' 10' ' ' GLN . 16.4 tt -118.06 122.88 70.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 127.555 2.342 . . . . 0.0 109.865 -176.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -161.2 174.12 14.08 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 127.755 2.422 . . . . 0.0 111.098 -177.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -71.9 85.78 0.97 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.683 1.593 . . . . 0.0 110.568 174.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -72.15 31.91 0.06 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 128.4 2.68 . . . . 0.0 116.921 -169.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -65.22 -11.15 37.91 Favored 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 116.896 2.184 . . . . 0.0 116.896 -166.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.6 mt -78.71 -14.62 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 125.726 1.61 . . . . 0.0 114.126 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.0 m-80 -74.66 -12.14 60.36 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.001 1.111 . . . . 0.0 114.001 -173.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.7 m -85.45 -26.89 26.07 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.274 1.213 . . . . 0.0 114.274 -177.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -96.91 -13.75 22.22 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -174.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.2 t -72.5 -31.33 37.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.512 1.125 . . . . 0.0 111.476 177.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.3 t -92.8 68.54 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.068 1.347 . . . . 0.0 110.739 -176.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.3 tp -129.31 151.13 50.3 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.292 1.437 . . . . 0.0 111.92 173.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.7 tttp -83.56 23.84 0.91 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.332 1.853 . . . . 0.0 114.326 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -34.57 99.12 0.16 Allowed Pre-proline 0 CA--C 1.555 1.152 0 C-N-CA 128.491 2.717 . . . . 0.0 114.359 -171.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -97.94 68.89 0.09 OUTLIER 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 122.804 2.336 . . . . 0.0 112.222 -164.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.4 mtp-105 -124.5 -38.33 2.42 Favored 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.8 t -123.79 84.88 53.86 Favored Pre-proline 0 N--CA 1.48 1.067 0 C-N-CA 124.729 1.211 . . . . 0.0 110.639 -176.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -76.79 171.62 17.66 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.45 2.767 . . . . 0.0 112.949 174.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.1 p -113.89 64.02 0.66 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.651 1.98 . . . . 0.0 112.737 -170.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.406 ' H ' ' NE2' ' A' ' 30' ' ' GLN . 1.5 pm0 -75.66 31.44 0.11 Allowed 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 115.954 1.835 . . . . 0.0 115.954 -175.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.8 ttpt -83.12 72.31 10.13 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.199 1.4 . . . . 0.0 111.279 -173.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.6 t -129.56 26.58 5.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.447 1.499 . . . . 0.0 113.22 -170.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.95 16.64 5.27 Favored Glycine 0 CA--C 1.539 1.572 0 C-N-CA 125.909 1.719 . . . . 0.0 114.912 178.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -105.03 30.89 5.2 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.714 2.006 . . . . 0.0 112.352 -175.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.6 tp 57.81 79.1 0.21 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.597 2.359 . . . . 0.0 113.908 177.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 53.1 m -95.5 -69.35 0.76 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.284 . . . . 0.0 112.729 -168.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -161.72 -43.42 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -172.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -73.4 -26.05 60.81 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.139 0.576 . . . . 0.0 110.59 175.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.7 mp0 -69.73 -41.57 75.13 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.357 1.463 . . . . 0.0 110.391 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -62.47 -36.27 81.94 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.807 0.843 . . . . 0.0 112.834 168.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -65.37 -3.97 4.91 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 172.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.6 mt -109.29 -20.59 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.834 1.654 . . . . 0.0 112.393 173.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.6 t -122.89 -53.88 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 CA-C-N 119.463 1.028 . . . . 0.0 113.634 -172.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.83 -33.34 73.97 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 119.616 1.098 . . . . 0.0 110.948 171.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -60.76 -43.88 97.42 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.874 0.87 . . . . 0.0 113.055 167.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -68.73 -36.24 78.16 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.624 1.17 . . . . 0.0 112.131 -178.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.95 -24.62 30.3 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.812 0 C-N-CA 124.883 1.273 . . . . 0.0 111.649 171.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -80.56 -16.86 53.16 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 114.025 1.121 . . . . 0.0 114.025 171.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -94.82 -50.65 5.04 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 120.668 -1.27 . . . . 0.0 112.009 -177.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 m -123.53 -13.84 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 -167.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 124.2 -75.42 0.39 Allowed Glycine 0 N--CA 1.469 0.888 0 C-N-CA 125.328 1.442 . . . . 0.0 112.913 163.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.5 tp -166.78 -40.74 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.437 1.495 . . . . 0.0 112.206 175.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -111.05 -5.19 14.84 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 -168.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -93.48 -17.99 22.8 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.101 0.961 . . . . 0.0 112.99 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -68.29 163.82 22.1 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.782 1.233 . . . . 0.0 112.096 165.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 31.0 p30 -116.78 169.75 9.13 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-O 122.454 1.121 . . . . 0.0 111.645 172.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.03 -24.44 40.77 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.308 1.043 . . . . 0.0 112.651 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.0 m -65.26 -45.3 85.06 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.802 1.641 . . . . 0.0 112.292 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.94 -38.23 90.28 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.517 -1.365 . . . . 0.0 111.931 175.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.3 mp -60.3 -51.09 71.0 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.5 0.72 . . . . 0.0 112.167 172.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.5 p -65.51 -31.11 71.99 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 123.699 0.799 . . . . 0.0 113.116 -178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt -70.87 -41.71 71.04 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.29 1.436 . . . . 0.0 112.602 176.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.9 mtt-85 -96.19 -35.14 11.4 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.484 1.113 . . . . 0.0 113.416 -169.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.1 tt -91.64 -17.29 25.75 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 126.14 1.776 . . . . 0.0 112.099 179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 61.01 69.96 0.64 Allowed 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 126.212 1.805 . . . . 0.0 112.712 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.9 pt -136.79 162.89 34.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 128.384 2.674 . . . . 0.0 109.136 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.1 t -70.15 152.53 44.19 Favored 'General case' 0 N--CA 1.476 0.847 0 O-C-N 121.382 -0.824 . . . . 0.0 111.038 167.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.3 t -58.92 -36.07 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.052 0.941 . . . . 0.0 111.379 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -68.84 -32.26 71.82 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.861 1.06 . . . . 0.0 113.861 178.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -69.14 -35.52 76.46 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 118.592 -0.718 . . . . 0.0 111.117 171.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.25 -49.74 63.23 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 118.767 0.712 . . . . 0.0 110.568 175.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -54.11 -42.91 69.94 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.506 1.522 . . . . 0.0 112.563 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -87.02 -32.18 20.15 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -63.04 -37.77 88.51 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 120.505 -1.372 . . . . 0.0 112.25 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 49.6 mt -49.79 -44.77 20.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 C-N-CA 124.624 1.17 . . . . 0.0 111.739 175.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.9 ptmt -90.0 -25.2 20.98 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 114.737 1.384 . . . . 0.0 114.737 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -73.95 -27.22 60.9 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 119.848 1.204 . . . . 0.0 112.627 174.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.7 t -83.49 -39.03 21.03 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.193 0.997 . . . . 0.0 113.516 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -111.31 -32.47 6.73 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -171.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 tpt180 48.26 53.0 12.51 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 127.736 2.414 . . . . 0.0 114.175 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 89.6 mmm 64.29 -32.19 0.13 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 128.488 2.715 . . . . 0.0 115.655 -175.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 138.58 -34.29 2.12 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 126.354 1.93 . . . . 0.0 113.101 167.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -127.01 17.55 7.24 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.203 1.801 . . . . 0.0 113.216 175.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 5.0 m 52.15 33.3 12.03 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.415 1.486 . . . . 0.0 112.297 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 23.7 m120 52.61 30.8 9.12 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.514 1.526 . . . . 0.0 114.739 -175.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.94 -1.01 38.31 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 114.565 1.321 . . . . 0.0 114.565 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 46.4 p90 -68.7 13.75 0.09 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 126.628 1.971 . . . . 0.0 115.758 -175.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 13.7 pttt -91.65 -6.54 51.97 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.075 2.55 . . . . 0.0 114.318 -176.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 90.0 m -136.93 -42.09 0.59 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 125.808 1.643 . . . . 0.0 111.393 -173.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 32.7 pt -69.42 169.43 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 C-N-CA 123.738 0.815 . . . . 0.0 111.384 170.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt 67.53 -29.17 0.15 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 127.199 2.199 . . . . 0.0 115.791 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.2 ptp -94.29 -34.89 12.67 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.648 1.179 . . . . 0.0 113.606 177.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.9 m-85 -90.0 -25.67 20.74 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 173.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -150.45 131.98 14.79 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.162 0.985 . . . . 0.0 111.924 -173.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -159.39 65.49 0.39 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.011 1.324 . . . . 0.0 110.985 -177.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -129.4 139.87 51.52 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.176 1.391 . . . . 0.0 111.738 -176.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 44.5 t -133.42 -47.97 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 124.368 1.067 . . . . 0.0 112.698 -176.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.9 t -129.2 24.56 5.55 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.928 1.291 . . . . 0.0 112.487 -178.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 11.5 p 53.86 176.04 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 128.123 2.569 . . . . 0.0 115.283 -169.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -148.01 116.29 6.55 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.366 1.067 . . . . 0.0 111.544 177.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.0 m -141.53 121.14 13.34 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.614 1.566 . . . . 0.0 110.081 175.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 56.01 16.17 2.07 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.2 1.8 . . . . 0.0 115.77 -175.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -86.79 148.14 45.14 Favored Pre-proline 0 CA--C 1.544 0.736 0 C-N-CA 124.901 1.28 . . . . 0.0 111.987 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.82 120.52 7.43 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.283 2.656 . . . . 0.0 110.482 172.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -133.21 80.73 1.9 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.196 1.398 . . . . 0.0 110.189 -177.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -150.18 151.04 30.95 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 126.128 1.771 . . . . 0.0 111.745 -175.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo . . . . . 0 C--O 1.253 1.228 0 C-N-CA 123.814 3.009 . . . . 0.0 113.234 177.634 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.566 0 N-CA-C 111.85 -0.5 . . . . 0.0 111.85 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 31.8 p -72.98 149.87 42.95 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.214 1.006 . . . . 0.0 112.875 176.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 11.1 t60 -149.63 133.65 17.11 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.877 1.271 . . . . 0.0 110.362 175.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 23.7 mmt -127.35 94.16 3.92 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.645 1.178 . . . . 0.0 110.839 -176.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -148.49 -54.54 0.19 Allowed 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.251 1.42 . . . . 0.0 112.015 176.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 54.1 24.83 5.08 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 126.153 1.781 . . . . 0.0 115.485 177.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.4 mtt -143.91 -33.28 0.42 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.468 1.507 . . . . 0.0 113.906 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -95.97 -1.85 48.23 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.439 1.496 . . . . 0.0 112.377 172.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -149.4 60.03 1.02 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.554 1.542 . . . . 0.0 110.546 -166.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -142.88 148.22 36.63 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.864 1.265 . . . . 0.0 112.174 167.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -146.75 -54.75 0.25 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.565 1.146 . . . . 0.0 112.534 176.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -116.58 114.7 24.49 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.251 1.421 . . . . 0.0 110.216 -179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 29.3 mm -129.89 110.46 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.694 1.598 . . . . 0.0 108.309 -177.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.7 tt -142.72 9.9 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 124.364 1.066 . . . . 0.0 113.753 -172.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -101.12 107.97 19.53 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.803 -1.186 . . . . 0.0 110.882 177.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -158.29 -53.85 0.07 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.671 1.188 . . . . 0.0 111.943 174.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.8 pt -144.39 111.48 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 126.746 2.019 . . . . 0.0 109.515 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -159.1 150.28 20.16 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.667 1.187 . . . . 0.0 110.925 -176.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -80.95 77.85 7.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.068 0.947 . . . . 0.0 110.598 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.62 33.45 0.07 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 116.331 1.975 . . . . 0.0 116.331 -174.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.55 -72.31 0.25 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.44 1.896 . . . . 0.0 113.347 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 66.3 mt -123.81 -7.88 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.596 1.558 . . . . 0.0 112.985 -173.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -72.03 -12.71 61.35 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -172.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.5 t -93.98 -56.34 2.9 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.357 1.063 . . . . 0.0 112.499 173.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -71.64 -14.06 61.94 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -170.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.2 p -69.87 -23.18 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 124.274 1.03 . . . . 0.0 112.47 174.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.6 t -91.63 59.11 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 125.343 1.457 . . . . 0.0 110.699 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 22.5 mt -137.2 132.11 33.42 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.355 1.462 . . . . 0.0 112.099 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -135.7 19.94 3.3 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 126.418 1.887 . . . . 0.0 113.633 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -125.73 49.57 3.71 Favored Pre-proline 0 CA--C 1.559 1.324 0 C-N-CA 125.334 1.454 . . . . 0.0 113.751 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -80.15 66.73 8.78 Favored 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 123.568 2.845 . . . . 0.0 113.007 -174.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 73.6 mtt85 -112.76 -42.8 3.54 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.129 1.372 . . . . 0.0 114.354 -177.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.2 t 37.9 80.21 0.28 Allowed Pre-proline 0 N--CA 1.48 1.045 0 C-N-CA 128.113 2.565 . . . . 0.0 113.59 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -68.51 165.82 27.86 Favored 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 122.862 2.375 . . . . 0.0 113.95 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.7 p -119.73 61.88 0.83 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 125.627 1.571 . . . . 0.0 112.964 -157.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -99.42 18.57 17.45 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -169.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.24 27.09 0.26 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.988 2.115 . . . . 0.0 113.865 -172.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -145.2 14.53 1.47 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.821 1.248 . . . . 0.0 114.02 -164.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.7 37.27 0.72 Allowed Glycine 0 N--CA 1.475 1.297 0 O-C-N 120.626 -1.297 . . . . 0.0 114.209 -175.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -105.94 17.25 23.93 Favored 'General case' 0 CA--C 1.549 0.909 0 N-CA-C 114.384 1.253 . . . . 0.0 114.384 -167.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.5 mp -129.75 137.65 50.66 Favored 'General case' 0 C--N 1.343 0.287 0 C-N-CA 126.087 1.755 . . . . 0.0 109.444 176.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.9 m -114.46 -73.25 0.66 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.904 1.682 . . . . 0.0 112.855 -176.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -160.17 -32.38 0.06 Allowed 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 113.688 0.995 . . . . 0.0 113.688 -170.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -83.15 -27.43 30.1 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.909 0.484 . . . . 0.0 111.226 172.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.7 mp0 -75.4 -42.81 52.86 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.815 1.246 . . . . 0.0 111.437 -169.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.1 ptpt -70.8 -26.69 63.43 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.995 0.918 . . . . 0.0 112.61 174.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -66.54 -4.71 9.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 166.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.1 mt -107.09 -52.83 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 125.14 1.376 . . . . 0.0 110.258 166.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.82 -57.85 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 CA-C-N 119.231 0.923 . . . . 0.0 111.581 -173.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.64 67.82 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.366 0.53 . . . . 0.0 111.777 -177.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -57.85 -36.92 72.97 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 167.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.78 -38.19 70.34 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.195 0.998 . . . . 0.0 111.852 172.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -58.81 -35.01 53.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 O-C-N 120.24 -1.538 . . . . 0.0 110.749 174.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.2 m -77.15 -4.94 47.13 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.814 1.413 . . . . 0.0 114.814 172.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -107.26 -29.94 9.02 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 119.936 1.244 . . . . 0.0 113.436 -174.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.3 p -136.21 -22.22 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 N-CA-C 116.289 1.959 . . . . 0.0 116.289 -171.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 140.05 -86.31 0.21 Allowed Glycine 0 N--CA 1.47 0.935 0 C-N-CA 124.663 1.125 . . . . 0.0 111.801 174.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.424 HD11 ' ND2' ' A' ' 79' ' ' ASN . 45.5 tp -159.54 -42.98 0.05 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.844 1.258 . . . . 0.0 112.397 174.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 -117.3 2.92 12.58 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -168.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -94.95 -17.04 22.33 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.295 0.638 . . . . 0.0 112.281 -176.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.98 161.73 18.03 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 125.122 1.369 . . . . 0.0 112.087 168.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -110.78 162.3 14.91 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 122.564 1.173 . . . . 0.0 111.557 168.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -77.81 -24.94 48.64 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.614 1.166 . . . . 0.0 112.584 -179.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.2 m -64.02 -47.17 81.31 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.907 1.683 . . . . 0.0 111.731 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -62.59 -40.47 97.01 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.753 1.221 . . . . 0.0 113.074 177.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.51 -51.53 69.07 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.051 0.94 . . . . 0.0 111.278 168.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 69.1 m -58.76 -30.38 67.48 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.341 1.456 . . . . 0.0 113.167 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -79.4 -18.52 52.13 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.554 1.542 . . . . 0.0 113.511 -179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -110.04 -36.66 5.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.194 1.398 . . . . 0.0 113.364 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.0 mp -80.24 -19.57 46.58 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.364 1.066 . . . . 0.0 112.663 171.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.12 63.12 1.48 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.175 1.39 . . . . 0.0 111.366 -176.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.6 pt -128.34 167.28 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 126.544 1.938 . . . . 0.0 111.947 -179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.1 m -65.06 134.53 54.02 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 125.954 1.702 . . . . 0.0 109.551 165.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.77 -34.37 55.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 122.992 0.517 . . . . 0.0 111.742 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.2 -28.76 66.66 Favored 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 113.854 1.057 . . . . 0.0 113.854 177.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 80.0 mttt -68.87 -36.95 78.72 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.272 170.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.62 -49.08 61.98 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.704 0.684 . . . . 0.0 110.437 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -53.31 -42.63 66.87 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.119 1.368 . . . . 0.0 112.594 177.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -87.79 -32.63 18.98 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -62.62 -38.96 92.27 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.179 -0.951 . . . . 0.0 112.228 178.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 48.6 mt -48.06 -65.6 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 125.013 1.325 . . . . 0.0 109.851 173.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -67.76 -28.64 67.79 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.1 m-80 -77.54 -28.68 51.96 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 120.027 1.285 . . . . 0.0 113.152 178.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.0 t -79.56 -44.15 21.66 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.945 0.898 . . . . 0.0 111.902 172.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.424 ' ND2' HD11 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -150.54 87.13 1.42 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 125.252 1.421 . . . . 0.0 111.117 -176.441 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 64.9 ttt-85 -70.94 -44.16 66.66 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.634 1.174 . . . . 0.0 113.149 176.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 92.1 mtp -125.51 -21.32 4.53 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.69 1.596 . . . . 0.0 113.055 -176.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 108.98 -27.18 13.34 Favored Glycine 0 N--CA 1.476 1.318 0 C-N-CA 125.569 1.557 . . . . 0.0 115.019 166.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 58.6 mtt85 -122.25 28.97 7.2 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 126.306 1.842 . . . . 0.0 112.759 172.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.5 m 50.44 32.75 6.83 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.668 1.987 . . . . 0.0 113.145 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.259 0.8 OUTLIER 46.11 26.67 0.45 Allowed 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 126.765 2.026 . . . . 0.0 115.977 -170.589 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.12 -8.28 25.42 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.719 1.208 . . . . 0.0 114.155 -175.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.7 p90 -72.83 15.52 0.19 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 126.442 1.897 . . . . 0.0 115.058 -174.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -89.32 -5.13 57.79 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 128.093 2.557 . . . . 0.0 114.726 -169.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 93.8 m -138.19 -50.47 0.58 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 126.206 1.802 . . . . 0.0 109.954 -171.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 43.2 pt -66.9 165.08 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 124.813 1.245 . . . . 0.0 112.279 172.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.57 -7.2 0.19 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 127.452 2.301 . . . . 0.0 116.018 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 47.3 mtm -93.23 -44.1 8.5 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 119.875 1.216 . . . . 0.0 113.518 -178.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -109.85 -6.05 15.35 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 -176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -76.46 159.34 30.5 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.052 1.341 . . . . 0.0 112.289 177.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -76.02 123.42 25.72 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.469 -0.769 . . . . 0.0 111.258 174.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -140.62 146.81 38.44 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.989 1.716 . . . . 0.0 110.399 175.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.3 t -122.93 -44.02 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.587 1.155 . . . . 0.0 111.217 -174.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 74.8 p -113.54 2.31 15.3 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.633 1.573 . . . . 0.0 114.267 179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 t -138.02 26.06 2.73 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.84 1.656 . . . . 0.0 113.172 -176.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.4 169.35 18.48 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.805 1.242 . . . . 0.0 112.649 176.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 15.6 t -129.62 165.67 21.31 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.388 1.475 . . . . 0.0 111.788 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -78.38 28.08 0.2 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 126.415 1.886 . . . . 0.0 113.944 -175.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 47.52 60.04 15.76 Favored Pre-proline 0 CA--C 1.552 1.048 0 C-N-CA 127.364 2.266 . . . . 0.0 113.686 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -77.81 57.12 5.93 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 124.963 3.775 . . . . 0.0 112.714 -177.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -136.7 95.0 3.06 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.662 1.585 . . . . 0.0 109.784 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 52.5 tp -121.43 91.39 48.29 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 125.525 1.53 . . . . 0.0 110.31 -178.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo . . . . . 0 C--O 1.253 1.263 0 C-N-CA 123.862 3.041 . . . . 0.0 113.277 -178.974 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.537 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 5.9 t -72.26 164.01 26.99 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.881 0.872 . . . . 0.0 112.463 175.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -139.91 130.73 25.99 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 124.775 1.23 . . . . 0.0 110.98 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 89.2 mmm -131.23 105.3 7.57 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.405 1.482 . . . . 0.0 111.007 177.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -142.68 -44.27 0.31 Allowed 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.843 1.257 . . . . 0.0 112.855 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 32.7 m 55.42 -10.04 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 118.485 2.772 . . . . 0.0 118.485 177.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.7 mtm -121.2 -9.64 9.09 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 126.239 1.816 . . . . 0.0 113.793 -177.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -123.77 14.75 9.36 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 127.149 2.18 . . . . 0.0 111.326 174.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -156.18 8.0 0.22 Allowed 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.171 1.389 . . . . 0.0 113.158 -149.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.6 tp -146.03 133.57 20.9 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.676 1.19 . . . . 0.0 111.4 -175.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 45.9 m-20 54.51 15.07 0.92 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 126.561 1.944 . . . . 0.0 115.73 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -104.86 83.46 2.01 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.705 1.602 . . . . 0.0 110.936 -177.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.9 mp -123.36 68.72 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 125.375 1.47 . . . . 0.0 108.545 176.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.1 mt -128.97 137.26 57.69 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 126.165 1.786 . . . . 0.0 108.77 -178.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -144.47 157.56 44.18 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.328 1.451 . . . . 0.0 110.749 -177.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -62.14 141.38 58.19 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.505 -0.747 . . . . 0.0 112.362 176.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 33.5 pt -138.08 133.08 43.83 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 C-N-CA 126.575 1.95 . . . . 0.0 109.971 179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -133.33 -78.29 0.48 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 125.8 1.64 . . . . 0.0 109.97 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -152.36 25.12 0.61 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.497 1.919 . . . . 0.0 112.487 -178.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -70.39 -30.31 67.17 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 120.754 -1.217 . . . . 0.0 112.836 -175.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 48.92 29.37 2.31 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 125.728 1.611 . . . . 0.0 113.777 -172.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . 0.281 5.2 mp 61.23 7.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 127.088 2.155 . . . . 0.0 114.073 -174.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -72.67 -19.58 61.4 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 120.102 -1.624 . . . . 0.0 113.555 -170.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 51.0 m -97.18 -46.1 6.27 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.432 0.693 . . . . 0.0 112.23 -173.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -74.76 -13.45 60.59 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 91.7 t -94.84 -30.51 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 125.04 1.336 . . . . 0.0 112.228 174.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.1 t -129.53 87.8 1.08 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.86 1.264 . . . . 0.0 109.974 -177.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -137.8 131.75 31.64 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.169 1.388 . . . . 0.0 111.32 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.0 mttm -139.85 15.17 2.49 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 114.778 1.399 . . . . 0.0 114.778 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -135.44 74.55 60.17 Favored Pre-proline 0 CA--C 1.55 0.967 0 C-N-CA 124.887 1.275 . . . . 0.0 112.664 -176.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -81.24 64.48 8.79 Favored 'Trans proline' 0 CA--C 1.543 0.961 0 C-N-CA 123.752 2.968 . . . . 0.0 112.364 179.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 75.9 mtt-85 -131.79 -55.64 1.0 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.366 1.466 . . . . 0.0 114.031 -176.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.0 t 41.7 64.96 5.09 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 127.263 2.225 . . . . 0.0 113.267 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -75.48 158.34 40.37 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.036 2.491 . . . . 0.0 113.838 -174.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.4 p -78.46 59.81 2.48 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 128.307 2.643 . . . . 0.0 113.76 -174.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -82.84 22.54 0.91 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 126.195 1.798 . . . . 0.0 115.736 -172.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.1 tppt? -87.26 65.04 8.61 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.714 2.006 . . . . 0.0 112.37 -168.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.4 t -150.63 11.06 0.66 Allowed 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -165.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -147.87 32.06 1.32 Allowed Glycine 0 N--CA 1.476 1.331 0 O-C-N 120.544 -1.347 . . . . 0.0 115.517 -169.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -76.98 -50.4 13.26 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 118.383 1.091 . . . . 0.0 113.927 -169.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.6 mp -142.18 133.8 26.81 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.344 1.858 . . . . 0.0 110.329 178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 67.2 p -95.75 -87.51 0.29 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.657 1.983 . . . . 0.0 111.722 179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -159.34 -36.96 0.06 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.494 1.118 . . . . 0.0 112.567 -172.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -68.44 -33.26 73.88 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.755 0.822 . . . . 0.0 110.471 168.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -72.23 -31.31 65.72 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.455 1.102 . . . . 0.0 111.404 -175.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.26 -42.49 99.38 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.291 1.036 . . . . 0.0 113.722 165.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -60.42 -9.38 3.54 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 172.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.5 mt -99.26 -57.27 4.58 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 125.14 1.376 . . . . 0.0 111.153 166.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.29 -55.63 13.91 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 119.573 1.078 . . . . 0.0 112.8 -172.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.04 -32.67 74.5 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.674 -0.641 . . . . 0.0 111.056 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -62.76 -34.26 76.86 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 171.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.31 -36.5 63.72 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.563 1.145 . . . . 0.0 111.703 174.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.89 -33.82 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 O-C-N 120.138 -1.601 . . . . 0.0 110.389 169.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 75.1 m -79.75 -3.54 48.01 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 170.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -101.27 -40.39 7.16 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 119.996 1.271 . . . . 0.0 112.501 -178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.3 p -132.98 -22.8 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 115.335 1.605 . . . . 0.0 115.335 -169.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 142.98 -84.9 0.19 Allowed Glycine 0 N--CA 1.469 0.883 0 C-N-CA 124.559 1.076 . . . . 0.0 111.517 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.6 tt -165.6 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 111.302 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -104.85 -9.31 18.11 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.591 1.556 . . . . 0.0 114.771 -166.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -92.17 -16.95 25.57 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 118.66 0.664 . . . . 0.0 112.713 -174.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.3 pp -64.93 161.21 18.96 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.334 1.454 . . . . 0.0 114.521 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 62.1 t-20 -100.95 123.4 45.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.011 1.324 . . . . 0.0 110.948 -177.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.55 -28.84 70.14 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.673 1.189 . . . . 0.0 113.022 177.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.2 m -68.33 -42.63 79.03 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.555 0.742 . . . . 0.0 111.671 176.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -62.2 -37.83 86.82 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.37 -0.831 . . . . 0.0 112.382 175.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 41.1 mt -62.38 -47.37 84.45 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 121.692 -0.63 . . . . 0.0 111.868 168.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.7 p -60.28 -27.16 67.06 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 -178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 42.9 mttm -76.0 -26.65 56.93 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.252 1.821 . . . . 0.0 112.941 179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -105.18 -37.62 6.84 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.367 1.467 . . . . 0.0 112.885 -177.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 7.4 mp -80.14 -17.14 53.31 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.417 1.087 . . . . 0.0 112.453 173.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 59.49 60.23 2.35 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.205 1.402 . . . . 0.0 112.079 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.6 pt -128.76 175.76 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 127.971 2.509 . . . . 0.0 109.645 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.498 HG23 ' H ' ' A' ' 70' ' ' LYS . 10.1 t -77.09 148.64 35.97 Favored 'General case' 0 N--CA 1.472 0.672 0 O-C-N 121.407 -0.808 . . . . 0.0 110.675 163.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.7 t -56.93 -29.78 31.89 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.37 1.068 . . . . 0.0 111.153 174.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -70.63 -29.65 66.07 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.697 0.999 . . . . 0.0 113.697 -178.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.498 ' H ' HG23 ' A' ' 67' ' ' THR . 91.0 mttt -73.87 -37.13 64.84 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 118.818 -0.61 . . . . 0.0 111.183 167.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.88 -47.07 76.06 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.425 0.557 . . . . 0.0 111.006 -177.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 53.8 pttt -70.6 -20.49 62.76 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -176.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.5 t -93.41 -39.27 11.01 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.085 0.857 . . . . 0.0 112.336 171.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -55.69 -42.57 75.39 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 121.139 -0.976 . . . . 0.0 112.292 177.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 43.5 mt -47.39 -63.98 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 124.699 1.2 . . . . 0.0 110.455 175.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 47.3 pttt -73.37 -32.52 64.55 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 -175.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -76.2 -34.59 59.28 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 118.801 0.728 . . . . 0.0 112.295 -177.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.2 t -85.31 -48.96 8.56 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.623 0.769 . . . . 0.0 112.665 176.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -115.41 85.34 2.25 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.477 1.111 . . . . 0.0 112.721 -178.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.94 -9.56 26.0 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 172.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 65.0 mtt -93.1 -46.35 7.48 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 -172.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 89.76 127.16 3.2 Favored Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.672 1.13 . . . . 0.0 112.14 -174.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 72.8 mmt-85 46.86 33.64 2.28 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 125.628 1.571 . . . . 0.0 113.682 -176.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.1 m 47.15 33.22 2.35 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 126.946 2.098 . . . . 0.0 113.524 -174.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.68 31.91 13.62 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 126.456 1.902 . . . . 0.0 114.3 -174.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -99.81 -9.26 23.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 124.778 1.231 . . . . 0.0 113.977 177.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -75.79 15.88 0.46 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 126.482 1.913 . . . . 0.0 115.05 -175.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 11.4 pttp -84.06 9.68 11.92 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 127.944 2.498 . . . . 0.0 115.165 -170.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -145.62 -46.5 0.21 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.397 1.879 . . . . 0.0 110.054 -168.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.1 mt -74.59 161.83 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 126.131 1.772 . . . . 0.0 109.289 175.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.72 -9.52 0.18 Allowed 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 117.086 2.254 . . . . 0.0 117.086 177.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 36.8 mtm -93.12 -32.24 14.51 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.05 1.13 . . . . 0.0 114.05 -175.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -100.61 -10.79 20.61 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.255 1.022 . . . . 0.0 113.631 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -82.1 42.86 0.75 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 126.092 1.757 . . . . 0.0 113.185 -171.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -80.83 157.86 25.57 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.465 1.506 . . . . 0.0 114.341 -177.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.9 t0 62.25 160.44 0.07 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 127.592 2.357 . . . . 0.0 115.001 -173.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.3 t -138.8 -42.09 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.517 1.527 . . . . 0.0 111.822 -173.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.3 m -129.34 16.17 6.06 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.905 1.282 . . . . 0.0 113.169 -175.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.0 t 58.37 64.72 1.41 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.053 1.741 . . . . 0.0 113.105 -176.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.81 147.86 46.8 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.157 0.983 . . . . 0.0 112.35 175.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.5 m -138.64 117.35 12.25 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.701 1.2 . . . . 0.0 111.5 -176.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.53 29.9 7.75 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.481 1.513 . . . . 0.0 114.403 -175.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -123.06 149.85 58.03 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 127.067 2.147 . . . . 0.0 111.373 -173.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -80.32 61.12 8.11 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 124.283 3.322 . . . . 0.0 111.662 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 52.44 40.48 29.64 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.85 1.66 . . . . 0.0 112.72 -172.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 4.1 tt -116.54 100.46 53.45 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.966 1.706 . . . . 0.0 110.012 -170.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo . . . . . 0 C--O 1.253 1.269 0 C-N-CA 124.057 3.171 . . . . 0.0 113.494 -178.071 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.555 0 CA-C-O 121.149 0.305 . . . . 0.0 112.892 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 25.4 p -75.82 133.57 40.59 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.721 1.209 . . . . 0.0 112.85 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -156.09 109.67 2.73 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.612 1.565 . . . . 0.0 109.711 176.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 94.4 mtp -137.5 93.8 2.85 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.874 1.27 . . . . 0.0 110.291 175.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.41 98.35 2.38 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.913 1.285 . . . . 0.0 110.667 178.045 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 68.3 p -122.1 4.35 9.84 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.156 1.783 . . . . 0.0 114.607 -174.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.9 ptp -143.28 -7.99 0.78 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 115.583 1.697 . . . . 0.0 115.583 -168.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -133.21 12.5 4.22 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 126.279 1.832 . . . . 0.0 112.04 -177.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.26 17.02 1.53 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.072 1.749 . . . . 0.0 112.202 -164.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.1 mp -115.82 75.09 0.93 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.029 1.732 . . . . 0.0 109.677 -178.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -137.12 -4.71 1.9 Allowed 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 -175.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -98.72 86.38 3.53 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.012 1.325 . . . . 0.0 111.106 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.4 mp -130.45 71.86 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.415 1.486 . . . . 0.0 109.27 178.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 36.0 mm -130.62 144.25 38.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 126.336 1.854 . . . . 0.0 109.779 -177.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -125.92 124.8 41.61 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.858 1.263 . . . . 0.0 110.495 172.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -153.98 -46.15 0.09 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.716 1.206 . . . . 0.0 112.397 178.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.1 tt -153.68 121.93 0.69 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 C-N-CA 126.74 2.016 . . . . 0.0 109.069 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.5 mp0 -138.42 170.59 15.74 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.85 1.66 . . . . 0.0 111.217 -174.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -73.66 73.22 1.49 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.809 1.243 . . . . 0.0 110.374 167.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -73.22 108.25 6.0 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.688 1.195 . . . . 0.0 110.633 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -130.02 -69.67 0.66 Allowed 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.45 1.1 . . . . 0.0 112.893 175.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 54.8 mt -122.62 -11.76 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.57 1.148 . . . . 0.0 113.778 -173.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -74.0 -14.48 61.03 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -173.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 29.6 p -93.04 -63.67 1.19 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.709 1.604 . . . . 0.0 112.173 178.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -72.12 -10.61 60.02 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -170.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.3 p -74.54 -17.64 16.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 123.7 0.8 . . . . 0.0 112.574 172.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 14.3 t -119.32 75.39 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 125.788 1.635 . . . . 0.0 109.25 174.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.9 tp -139.4 150.63 45.52 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.764 1.225 . . . . 0.0 112.108 -174.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.04 45.6 2.67 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.706 1.602 . . . . 0.0 112.838 -171.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 49.05 72.64 1.19 Allowed Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 126.474 1.91 . . . . 0.0 114.246 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -77.64 61.66 7.55 Favored 'Trans proline' 0 CA--C 1.546 1.105 0 C-N-CA 124.311 3.341 . . . . 0.0 111.522 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? 53.38 55.54 8.57 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.275 2.23 . . . . 0.0 113.054 -176.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 32.0 t -114.48 89.16 17.33 Favored Pre-proline 0 N--CA 1.479 1.024 0 C-N-CA 125.194 1.398 . . . . 0.0 110.206 176.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.99 166.24 30.12 Favored 'Trans proline' 0 CA--C 1.534 0.525 0 C-N-CA 123.012 2.475 . . . . 0.0 112.926 171.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 p -127.0 70.88 1.3 Allowed 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 125.643 1.577 . . . . 0.0 112.645 -163.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.45 ' H ' ' NE2' ' A' ' 30' ' ' GLN . 2.7 pm0 -95.87 23.25 6.48 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.926 1.691 . . . . 0.0 114.922 -177.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.81 60.86 4.9 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.36 1.864 . . . . 0.0 111.388 -174.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.2 t -141.01 10.9 2.18 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.957 1.303 . . . . 0.0 114.423 -171.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.83 -50.1 31.86 Favored Glycine 0 CA--C 1.535 1.312 0 O-C-N 120.764 -1.21 . . . . 0.0 114.179 -175.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 51.73 33.67 11.52 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 126.331 1.852 . . . . 0.0 115.057 173.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.0 mp 53.8 89.96 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 127.442 2.297 . . . . 0.0 113.835 -176.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.4 t -82.01 -73.06 0.41 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.914 0.886 . . . . 0.0 111.899 -177.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -162.87 -36.5 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 123.053 0.541 . . . . 0.0 112.306 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -75.25 -33.4 61.29 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.733 0.413 . . . . 0.0 111.466 171.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 -69.35 -42.12 75.71 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.427 -0.795 . . . . 0.0 112.264 -171.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 ptpt -70.44 -25.58 63.26 Favored 'General case' 0 N--CA 1.476 0.825 0 O-C-N 121.2 -0.938 . . . . 0.0 113.068 172.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -71.89 2.48 5.46 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 166.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.9 mt -110.78 -43.22 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.572 1.549 . . . . 0.0 110.895 168.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.8 t -79.8 -63.89 1.05 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 CA-C-N 119.176 0.898 . . . . 0.0 112.447 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.06 -28.44 68.2 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.329 -0.857 . . . . 0.0 112.456 -175.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.71 -17.39 64.07 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 168.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -34.21 17.67 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 124.636 1.174 . . . . 0.0 111.093 170.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 12.5 mm -61.69 -21.76 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 O-C-N 120.537 -1.352 . . . . 0.0 112.451 177.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 79.4 p -90.3 -4.83 56.88 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 115.148 1.536 . . . . 0.0 115.148 171.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -93.54 -56.81 2.79 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 119.993 1.269 . . . . 0.0 112.517 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 33.0 m -117.61 -37.85 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 -166.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.45 -90.77 0.13 Allowed Glycine 0 CA--C 1.527 0.805 0 C-N-CA 125.08 1.324 . . . . 0.0 112.057 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 64.4 tp -167.35 -47.75 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.566 1.547 . . . . 0.0 111.52 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 72.5 m-80 -96.03 19.36 11.74 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.626 1.57 . . . . 0.0 113.163 -168.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.3 p30 -149.54 -5.02 0.38 Allowed 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 126.808 2.043 . . . . 0.0 113.268 -159.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.9 pp -80.91 161.66 24.26 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.086 1.354 . . . . 0.0 112.396 172.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.7 t-20 -98.62 113.99 26.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.376 0.608 . . . . 0.0 111.327 177.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.64 -23.23 65.92 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.379 1.472 . . . . 0.0 113.737 179.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.7 m -65.74 -38.23 88.55 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.132 0.973 . . . . 0.0 112.104 174.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -69.48 -35.18 75.33 Favored 'General case' 0 N--CA 1.47 0.575 0 O-C-N 120.599 -1.313 . . . . 0.0 112.146 177.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.6 mp -60.57 -54.62 43.23 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.404 0.682 . . . . 0.0 110.82 167.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.7 p -66.58 -28.43 68.51 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -173.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 77.9 mttt -61.2 -52.31 65.35 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.93 1.692 . . . . 0.0 112.473 170.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 1.4 mtp-105 -87.1 -35.82 18.46 Favored 'General case' 0 N--CA 1.481 1.107 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -172.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tt -80.72 -18.85 46.5 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.464 1.506 . . . . 0.0 111.402 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 62.75 65.21 0.84 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.303 1.841 . . . . 0.0 112.008 177.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.1 pt -131.24 174.01 13.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 127.175 2.19 . . . . 0.0 110.566 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.0 m -69.38 139.11 54.13 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.083 1.353 . . . . 0.0 109.247 165.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.2 t -57.36 -39.14 66.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 123.301 0.64 . . . . 0.0 111.575 -177.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -68.53 -27.94 66.55 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 113.442 0.905 . . . . 0.0 113.442 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -69.03 -35.14 76.28 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 118.553 -0.737 . . . . 0.0 111.286 173.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.96 -48.07 64.07 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.854 0.752 . . . . 0.0 110.469 172.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -56.23 -37.32 69.55 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.528 1.131 . . . . 0.0 112.934 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.9 t -86.87 -35.96 18.72 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 176.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 67.3 t80 -63.35 -35.42 80.33 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.041 -1.037 . . . . 0.0 112.916 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.4 mt -48.02 -44.37 11.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.99 1.316 . . . . 0.0 111.442 173.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -86.42 -34.86 20.02 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 113.362 0.875 . . . . 0.0 113.362 178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.9 m-80 -67.1 -30.4 70.41 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 118.299 0.5 . . . . 0.0 112.082 -178.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.7 t -81.27 -50.62 9.31 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.962 1.305 . . . . 0.0 113.712 176.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -95.35 -31.7 13.3 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -169.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 9.2 tpp85 44.2 36.11 1.43 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 128.846 2.858 . . . . 0.0 115.261 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.6 mtp 57.08 22.51 7.48 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.58 1.552 . . . . 0.0 114.422 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -98.15 40.26 2.54 Favored Glycine 0 N--CA 1.472 1.05 0 C-N-CA 125.249 1.404 . . . . 0.0 111.33 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? 53.48 -73.08 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 127.85 2.46 . . . . 0.0 111.215 -148.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 54.0 p -145.85 19.81 1.46 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.034 2.134 . . . . 0.0 114.084 -173.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 62.24 38.54 13.35 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 125.488 1.515 . . . . 0.0 113.18 -171.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 16.9 p30 -93.08 -2.78 55.19 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 175.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -72.46 16.25 0.15 Allowed 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 126.407 1.883 . . . . 0.0 115.291 -175.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.0 pttp -83.84 -6.08 59.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 127.004 2.122 . . . . 0.0 113.655 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 61.9 m -138.24 -47.79 0.53 Allowed 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 126.949 2.099 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.0 mt -76.83 156.0 5.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.776 1.23 . . . . 0.0 109.684 177.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt 67.82 -4.43 0.98 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 127.415 2.286 . . . . 0.0 116.698 178.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 34.5 mtm -85.99 -49.08 8.1 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 119.704 1.138 . . . . 0.0 112.359 177.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.1 m-85 -88.05 -19.29 27.31 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.574 1.15 . . . . 0.0 113.287 -174.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -97.64 13.1 31.37 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.18 1.792 . . . . 0.0 113.321 -172.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -75.87 112.57 12.42 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.597 1.159 . . . . 0.0 112.696 -178.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -143.01 141.62 31.39 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.492 1.917 . . . . 0.0 110.475 173.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.7 t -134.7 -49.76 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.571 1.148 . . . . 0.0 111.695 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 71.6 p -116.62 17.33 15.32 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.745 1.618 . . . . 0.0 113.667 -176.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 74.8 m 50.18 33.76 7.65 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 126.522 1.929 . . . . 0.0 114.194 -174.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -141.65 165.12 28.35 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.956 2.102 . . . . 0.0 110.971 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 59.5 m -142.96 158.73 43.32 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.04 1.336 . . . . 0.0 111.627 -168.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.52 28.61 9.97 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 125.226 1.411 . . . . 0.0 114.699 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 41.5 mt-30 -69.82 149.3 96.61 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 125.307 1.443 . . . . 0.0 111.806 -176.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -69.79 104.92 1.4 Allowed 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 123.137 2.558 . . . . 0.0 110.818 175.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -142.51 89.69 2.17 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.228 1.411 . . . . 0.0 109.808 -174.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 97.8 mt -125.88 78.28 69.81 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.498 1.519 . . . . 0.0 110.735 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.254 1.282 0 C-N-CA 124.027 3.151 . . . . 0.0 113.315 -179.875 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 51.8 m -127.82 155.01 44.77 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.498 1.519 . . . . 0.0 111.973 -178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -115.51 121.81 43.82 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.85 1.26 . . . . 0.0 111.5 -177.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 92.6 mtp -139.12 109.58 6.56 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 125.389 1.476 . . . . 0.0 109.563 178.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -145.44 39.45 1.17 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.296 1.439 . . . . 0.0 112.381 -172.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 15.0 m -118.12 18.25 13.87 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.222 1.409 . . . . 0.0 114.212 -159.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -150.89 -10.72 0.23 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 116.397 1.999 . . . . 0.0 116.397 -173.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -124.5 7.22 8.29 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 126.127 1.771 . . . . 0.0 112.798 178.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.56 26.19 3.73 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.904 1.682 . . . . 0.0 111.864 -167.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.0 mp -118.68 60.47 0.8 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.728 1.611 . . . . 0.0 110.602 -177.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -139.32 -38.34 0.49 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.466 1.106 . . . . 0.0 113.485 -178.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -79.32 24.79 0.33 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.68 1.592 . . . . 0.0 114.221 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.7 mt -76.76 139.68 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 126.225 1.81 . . . . 0.0 111.142 -172.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 75.7 mt -109.26 133.54 54.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 125.523 1.529 . . . . 0.0 109.359 175.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -133.91 127.15 31.89 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.131 1.372 . . . . 0.0 110.245 176.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -154.4 -57.98 0.11 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.807 0.843 . . . . 0.0 112.447 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.7 pt -139.36 99.12 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 125.574 1.55 . . . . 0.0 110.671 -177.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -132.02 -84.88 0.49 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.679 1.192 . . . . 0.0 110.584 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -147.76 25.99 1.03 Allowed 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 126.757 2.023 . . . . 0.0 111.861 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -76.78 122.53 24.9 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.678 1.191 . . . . 0.0 110.624 -174.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -134.61 -69.11 0.52 Allowed 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.488 1.515 . . . . 0.0 112.856 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.6 mt -111.14 -1.64 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.063 1.745 . . . . 0.0 112.563 -171.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -72.67 -18.98 61.51 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.413 1.485 . . . . 0.0 112.261 -171.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.2 t -80.98 -44.71 17.73 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.388 1.075 . . . . 0.0 112.371 178.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -83.68 -18.08 39.24 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 114.363 1.246 . . . . 0.0 114.363 -176.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 3.2 p -86.4 -13.88 10.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.452 1.101 . . . . 0.0 113.208 -178.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.9 t -122.56 74.28 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.678 1.591 . . . . 0.0 109.86 177.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 31.4 tp -140.93 142.6 34.38 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.119 1.368 . . . . 0.0 111.669 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -134.32 35.73 3.22 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 125.959 1.704 . . . . 0.0 113.66 -178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -132.91 66.28 75.91 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 123.959 0.904 . . . . 0.0 113.223 173.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -80.47 61.83 8.34 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.713 2.942 . . . . 0.0 112.354 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -121.02 -40.71 2.59 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.312 1.445 . . . . 0.0 114.195 -172.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.7 t -132.38 71.26 79.47 Favored Pre-proline 0 N--CA 1.482 1.166 0 C-N-CA 124.429 1.092 . . . . 0.0 111.259 -177.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -67.51 139.46 49.12 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 C-N-CA 123.302 2.668 . . . . 0.0 112.676 175.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.2 t -100.62 73.69 1.63 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.934 1.694 . . . . 0.0 111.815 -166.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -103.11 13.52 33.92 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.791 1.774 . . . . 0.0 115.791 -172.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.5 ttpt -89.03 59.9 5.2 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.402 1.481 . . . . 0.0 112.917 -164.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.6 t -133.17 6.21 3.87 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -171.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 167.81 38.9 0.02 OUTLIER Glycine 0 CA--C 1.533 1.215 0 O-C-N 121.002 -1.062 . . . . 0.0 114.706 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -76.1 -53.86 7.69 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 118.539 1.169 . . . . 0.0 113.112 -172.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.4 mp -126.03 112.35 15.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.507 2.323 . . . . 0.0 109.996 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -92.3 -81.94 0.33 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.998 1.319 . . . . 0.0 111.552 173.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -159.07 -29.62 0.07 Allowed 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 124.505 1.122 . . . . 0.0 112.66 -170.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -82.4 -31.63 29.53 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.204 0.602 . . . . 0.0 111.5 170.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.86 -41.66 82.55 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 121.232 -0.918 . . . . 0.0 112.288 -175.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.1 ptpt -69.46 -26.4 64.56 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 120.882 -1.136 . . . . 0.0 113.116 173.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -69.03 -3.6 13.71 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 166.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.1 mt -100.88 -54.56 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.788 1.235 . . . . 0.0 109.82 164.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 44.3 t -73.71 -56.7 8.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 119.398 0.999 . . . . 0.0 112.797 -171.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.08 -30.45 70.49 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.577 -0.702 . . . . 0.0 111.338 -178.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -60.55 -46.1 91.45 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 112.898 0.703 . . . . 0.0 112.898 167.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -66.61 -36.49 82.74 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.519 1.054 . . . . 0.0 111.826 178.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -59.94 -24.81 30.83 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 O-C-N 120.7 -1.25 . . . . 0.0 112.009 172.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -79.9 -16.2 55.82 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 171.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -93.96 -50.89 5.11 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.695 -1.253 . . . . 0.0 112.002 -177.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.7 m -124.49 -12.05 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -167.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 122.62 -74.82 0.37 Allowed Glycine 0 N--CA 1.468 0.831 0 C-N-CA 125.546 1.546 . . . . 0.0 112.602 164.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 50.5 tp -166.84 -41.34 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.332 1.453 . . . . 0.0 112.244 175.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 75.0 m-80 -108.81 -6.25 15.91 Favored 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 114.348 1.24 . . . . 0.0 114.348 -166.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -93.74 -19.45 21.06 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.156 0.982 . . . . 0.0 113.09 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.0 pp -65.93 162.48 19.07 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.861 1.264 . . . . 0.0 112.21 166.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -112.23 167.1 10.69 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 122.541 1.162 . . . . 0.0 111.876 172.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.54 -21.55 35.33 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.656 1.182 . . . . 0.0 112.81 -179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.4 m -63.88 -48.68 75.71 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 125.489 1.516 . . . . 0.0 111.394 179.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -65.12 -43.04 93.27 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 121.088 -1.007 . . . . 0.0 111.956 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -56.96 -54.53 45.65 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 123.784 0.834 . . . . 0.0 112.067 171.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.3 p -63.61 -21.83 66.57 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.138 1.162 . . . . 0.0 114.138 -179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 52.6 mtpt -79.21 -44.8 21.12 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.837 1.255 . . . . 0.0 112.094 175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -80.34 -36.55 34.02 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.65 1.18 . . . . 0.0 113.401 -179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 mt -87.64 -20.83 25.79 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.385 1.474 . . . . 0.0 113.167 -179.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.85 61.25 1.96 Allowed 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.27 1.428 . . . . 0.0 111.94 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -123.56 169.31 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 127.052 2.141 . . . . 0.0 110.557 174.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.2 m -65.57 138.53 58.1 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 124.832 1.253 . . . . 0.0 109.605 164.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 13.3 t -57.54 -38.06 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 123.407 0.683 . . . . 0.0 111.496 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -72.05 -25.93 61.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -69.82 -36.53 75.68 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 118.568 -0.729 . . . . 0.0 110.676 169.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.41 -48.13 71.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.852 0.751 . . . . 0.0 110.904 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -53.59 -41.01 66.14 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.292 1.437 . . . . 0.0 112.705 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.6 t -87.63 -33.34 18.86 Favored 'General case' 0 N--CA 1.477 0.925 0 N-CA-C 113.375 0.88 . . . . 0.0 113.375 178.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 78.2 t80 -63.29 -36.16 82.74 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.809 -1.182 . . . . 0.0 112.68 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.85 -45.38 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 124.847 1.259 . . . . 0.0 111.448 174.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -90.74 -27.7 18.76 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.7 m-80 -71.93 -28.2 63.32 Favored 'General case' 0 CA--C 1.543 0.704 0 CA-C-N 120.158 1.345 . . . . 0.0 112.805 176.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.8 t -85.04 -45.46 12.1 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.011 0.924 . . . . 0.0 113.308 178.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -96.7 -38.58 9.86 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.484 0.92 . . . . 0.0 113.484 -173.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 45.09 46.07 9.33 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 127.846 2.458 . . . . 0.0 113.844 178.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.3 mmt 60.67 -27.17 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 129.076 2.951 . . . . 0.0 116.768 -173.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.03 32.98 0.08 OUTLIER Glycine 0 CA--C 1.534 1.228 0 C-N-CA 125.839 1.685 . . . . 0.0 113.477 178.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 52.11 77.85 0.14 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.825 2.45 . . . . 0.0 113.94 -169.127 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 40.8 p 55.48 31.76 17.63 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 126.493 1.917 . . . . 0.0 114.349 168.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -71.45 -13.82 61.95 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.756 2.022 . . . . 0.0 112.496 -173.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -60.35 -19.9 57.37 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 128.764 2.826 . . . . 0.0 112.874 174.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.79 18.93 0.15 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.294 1.837 . . . . 0.0 115.443 -176.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.1 pmtp? -81.78 -4.35 56.15 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -167.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 37.2 m -142.87 -49.09 0.34 Allowed 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.108 1.763 . . . . 0.0 110.256 -167.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.9 pt -70.89 161.15 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 C-N-CA 124.694 1.198 . . . . 0.0 112.22 176.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 63.29 -9.02 0.13 Allowed 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 127.202 2.201 . . . . 0.0 116.389 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 39.6 mtm -89.04 -36.44 15.79 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.871 1.214 . . . . 0.0 113.462 -179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -86.83 -19.11 29.44 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -76.75 146.38 37.99 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.581 1.153 . . . . 0.0 111.512 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -145.0 133.85 22.38 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.488 1.115 . . . . 0.0 111.672 -176.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -92.22 137.54 32.28 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.383 1.073 . . . . 0.0 111.7 177.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.2 t -121.03 -48.89 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.469 1.108 . . . . 0.0 111.039 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 60.0 p -112.79 1.26 15.53 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.61 1.564 . . . . 0.0 113.963 176.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.9 m -119.21 5.38 11.24 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.868 1.667 . . . . 0.0 114.619 -171.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.57 130.62 39.11 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.33 -0.856 . . . . 0.0 112.014 -179.427 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.7 m -141.18 129.55 22.42 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.48 1.512 . . . . 0.0 110.278 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 57.32 14.92 2.35 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 115.829 1.789 . . . . 0.0 115.829 -176.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -86.13 148.26 47.19 Favored Pre-proline 0 CA--C 1.544 0.746 0 C-N-CA 124.779 1.231 . . . . 0.0 111.826 179.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -79.15 52.01 4.1 Favored 'Trans proline' 0 CA--C 1.546 1.086 0 C-N-CA 124.455 3.436 . . . . 0.0 111.722 173.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -128.45 71.15 1.38 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.015 1.726 . . . . 0.0 110.839 -170.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 8.1 mp -114.47 88.87 16.58 Favored Pre-proline 0 CA--C 1.55 0.957 0 C-N-CA 125.348 1.459 . . . . 0.0 109.515 178.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo . . . . . 0 C--O 1.253 1.272 0 C-N-CA 123.862 3.041 . . . . 0.0 113.218 -179.779 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.709 0 N-CA-C 111.999 -0.441 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 4.5 t 57.74 -171.07 0.1 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.567 1.547 . . . . 0.0 113.771 -172.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -134.57 127.33 31.07 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.724 1.609 . . . . 0.0 110.172 175.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 66.0 mtt -133.63 92.27 2.96 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.845 1.258 . . . . 0.0 110.3 -175.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.58 97.85 2.3 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.538 1.135 . . . . 0.0 110.854 178.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 22.7 m -124.04 -2.15 8.21 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -175.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -146.91 1.96 0.78 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 115.03 1.492 . . . . 0.0 115.03 -176.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -121.52 8.7 10.15 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 126.203 1.801 . . . . 0.0 111.869 171.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.47 49.05 1.1 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 126.065 1.746 . . . . 0.0 110.79 -165.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -140.9 149.86 42.46 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.09 1.756 . . . . 0.0 111.523 171.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -153.05 -52.33 0.1 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.428 1.091 . . . . 0.0 112.267 175.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -135.8 72.37 1.44 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.685 1.594 . . . . 0.0 109.447 -177.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.7 mm -115.76 119.17 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.568 1.547 . . . . 0.0 109.626 -173.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 41.8 mt -139.81 103.13 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.943 1.297 . . . . 0.0 109.803 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -131.3 106.47 8.31 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.679 1.592 . . . . 0.0 109.495 174.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -156.12 148.98 24.08 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.296 1.438 . . . . 0.0 110.759 -176.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.274 39.1 pt 43.91 60.67 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 C-N-CA 126.988 2.115 . . . . 0.0 114.634 176.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -92.76 -88.18 0.22 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.167 1.387 . . . . 0.0 111.191 -172.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -150.96 28.36 0.68 Allowed 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 126.728 2.011 . . . . 0.0 111.726 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -86.37 122.09 29.86 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.536 1.134 . . . . 0.0 110.812 -177.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -139.14 -71.75 0.4 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.655 1.582 . . . . 0.0 112.079 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.0 mt -124.35 -1.1 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 124.966 1.307 . . . . 0.0 113.375 -168.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -67.22 -21.82 65.74 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.032 -1.042 . . . . 0.0 113.035 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 59.0 p -80.82 -32.65 35.13 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -173.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -101.44 -13.35 17.99 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -176.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 70.0 t -85.19 -36.81 11.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.956 0.903 . . . . 0.0 111.36 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.4 t -106.7 80.56 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 124.946 1.298 . . . . 0.0 109.768 -177.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.4 tp -120.84 152.42 38.41 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.699 1.6 . . . . 0.0 111.65 -178.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -129.93 25.48 5.28 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.541 1.536 . . . . 0.0 114.24 -174.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -131.79 61.29 57.42 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.61 1.164 . . . . 0.0 113.332 173.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -80.52 67.61 8.58 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.519 2.813 . . . . 0.0 112.014 -179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 94.4 mtt-85 -122.25 -64.59 1.19 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.004 1.321 . . . . 0.0 113.325 -173.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 10.8 p -158.02 126.75 2.99 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 125.324 1.45 . . . . 0.0 111.059 -178.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -83.17 140.68 9.98 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.8 3.0 . . . . 0.0 111.332 168.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.1 t -130.29 72.0 1.48 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 122.848 1.309 . . . . 0.0 111.754 -176.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -122.31 17.5 10.64 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.391 1.477 . . . . 0.0 114.045 -174.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.53 41.85 1.06 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 126.433 1.893 . . . . 0.0 111.822 -174.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.2 t -138.1 7.81 2.69 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.883 1.273 . . . . 0.0 114.184 -169.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.16 -56.78 7.5 Favored Glycine 0 CA--C 1.536 1.4 0 O-C-N 120.805 -1.185 . . . . 0.0 114.467 -170.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -92.68 -33.94 14.16 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -177.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp -143.95 142.29 30.66 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.202 2.201 . . . . 0.0 108.997 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 47.8 t -116.37 -72.54 0.69 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 126.439 1.896 . . . . 0.0 111.84 176.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.84 -45.95 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 122.975 0.51 . . . . 0.0 111.158 -172.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -63.48 -30.65 71.74 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 123.467 0.707 . . . . 0.0 110.941 174.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -69.14 -35.4 76.32 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.392 1.077 . . . . 0.0 111.842 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -70.54 -35.66 73.26 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 121.394 -0.816 . . . . 0.0 112.167 170.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -62.61 -7.43 4.74 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 170.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.3 mt -102.98 -55.43 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 C-N-CA 125.581 1.552 . . . . 0.0 110.609 170.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 39.3 t -83.9 -55.2 7.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -172.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.02 -30.04 70.99 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.874 0.761 . . . . 0.0 112.189 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.17 -38.36 79.59 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.216 0.606 . . . . 0.0 112.431 167.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.82 -36.82 78.68 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.263 1.025 . . . . 0.0 111.694 173.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.79 -26.66 40.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 O-C-N 120.851 -1.156 . . . . 0.0 111.555 176.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.8 m -81.0 -8.73 59.84 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.954 1.464 . . . . 0.0 114.954 171.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -98.78 -57.84 2.09 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 120.477 1.489 . . . . 0.0 112.33 -178.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.6 m -118.0 -18.32 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 114.728 1.381 . . . . 0.0 114.728 -164.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.98 -92.27 0.27 Allowed Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.73 1.634 . . . . 0.0 110.468 173.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -166.82 -29.41 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 126.197 1.799 . . . . 0.0 112.976 173.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -99.36 -14.58 19.12 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.399 1.48 . . . . 0.0 114.133 -176.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -93.87 -14.99 25.47 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.216 1.006 . . . . 0.0 113.413 -175.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.5 pp -70.85 166.29 21.4 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.639 1.576 . . . . 0.0 114.0 177.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -108.88 115.63 30.45 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.621 1.169 . . . . 0.0 111.189 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.92 -27.36 63.27 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 125.002 1.321 . . . . 0.0 113.775 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 97.9 m -65.89 -40.01 91.18 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.102 0.961 . . . . 0.0 111.939 175.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -66.33 -37.41 85.31 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 120.437 -1.414 . . . . 0.0 112.244 176.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -61.68 -50.12 73.78 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.169 0.587 . . . . 0.0 110.817 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 92.6 p -69.9 -29.66 66.9 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -175.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -66.19 -36.59 83.49 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.321 1.449 . . . . 0.0 112.974 173.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.4 mmt-85 -92.83 -39.29 11.28 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.672 1.189 . . . . 0.0 113.535 -176.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.2 tt -80.82 -20.2 42.99 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.628 1.171 . . . . 0.0 111.976 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 66.24 65.79 0.49 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.67 1.988 . . . . 0.0 112.403 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.6 pt -132.65 -178.09 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 128.118 2.567 . . . . 0.0 109.295 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.9 t -81.53 156.13 25.41 Favored 'General case' 0 N--CA 1.476 0.852 0 O-C-N 121.361 -0.837 . . . . 0.0 111.052 165.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -58.51 -39.37 75.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.163 0.985 . . . . 0.0 111.241 -178.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 -69.76 -26.47 64.32 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -66.83 -40.42 87.98 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 118.701 0.682 . . . . 0.0 111.186 168.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.82 -48.68 65.56 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.349 0.522 . . . . 0.0 109.903 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.1 mtpt -53.57 -39.06 64.48 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 125.433 1.493 . . . . 0.0 112.707 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.8 t -84.65 -41.77 16.0 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 118.851 0.75 . . . . 0.0 112.509 175.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -60.59 -35.98 77.44 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 121.14 -0.975 . . . . 0.0 113.129 -179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 25.2 mt -47.62 -51.65 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 125.297 1.439 . . . . 0.0 111.342 173.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -85.35 -33.46 22.04 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 178.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.73 -29.48 68.72 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.828 0.677 . . . . 0.0 112.828 -176.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.9 t -85.06 -41.64 15.57 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.672 1.189 . . . . 0.0 113.532 176.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -142.46 48.19 1.56 Allowed 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -167.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 65.9 ttt180 -54.98 -40.25 69.87 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.767 1.227 . . . . 0.0 113.709 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 64.1 mtt -86.53 -25.24 25.16 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.714 1.206 . . . . 0.0 113.107 -177.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.4 -14.34 64.07 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 125.413 1.483 . . . . 0.0 114.878 175.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -118.52 23.21 11.65 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 126.341 1.857 . . . . 0.0 112.866 170.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.7 m 48.65 38.58 11.69 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 127.237 2.215 . . . . 0.0 113.109 177.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 57.11 5.61 0.27 Allowed 'General case' 0 CA--C 1.556 1.183 0 N-CA-C 116.167 1.914 . . . . 0.0 116.167 -174.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.1 -3.06 50.75 Favored 'General case' 0 CA--C 1.55 0.955 0 O-C-N 119.749 -1.844 . . . . 0.0 114.186 -170.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -70.06 12.76 0.19 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.934 2.094 . . . . 0.0 115.077 -176.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -86.04 -15.42 41.38 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.873 1.669 . . . . 0.0 113.883 -173.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.5 m -123.37 -42.88 2.21 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.167 1.787 . . . . 0.0 110.857 -171.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.3 mt -72.33 166.61 2.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 124.612 1.165 . . . . 0.0 108.783 167.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.2 mmpt? 67.58 -8.31 0.51 Allowed 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 126.996 2.119 . . . . 0.0 116.138 176.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.26 -10.4 8.96 Favored 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -114.9 -14.91 11.88 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -161.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -89.81 7.46 36.91 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.963 1.305 . . . . 0.0 114.116 179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -95.51 154.97 16.94 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.871 1.668 . . . . 0.0 113.369 -172.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -76.16 145.86 39.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.113 0.965 . . . . 0.0 111.8 171.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.4 t -131.75 -47.51 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 C-N-CA 124.269 1.028 . . . . 0.0 112.218 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.4 m -116.07 3.27 13.55 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.794 1.238 . . . . 0.0 113.315 -177.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.2 m -94.32 -5.27 47.0 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.246 1.418 . . . . 0.0 114.465 -169.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -83.62 139.86 32.56 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.952 1.301 . . . . 0.0 112.665 -176.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 72.1 m -147.43 146.34 29.53 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 125.642 1.577 . . . . 0.0 110.968 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 55.04 19.37 2.71 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 126.071 1.748 . . . . 0.0 115.717 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 51.4 mm-40 -73.84 150.35 88.34 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 124.529 1.131 . . . . 0.0 111.878 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -79.91 64.14 8.82 Favored 'Trans proline' 0 CA--C 1.544 0.987 0 C-N-CA 124.375 3.384 . . . . 0.0 111.669 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 52.67 43.21 31.53 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.865 1.666 . . . . 0.0 112.207 -171.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.2 tp -123.6 89.42 51.29 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.446 1.498 . . . . 0.0 110.639 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 C--O 1.252 1.195 0 C-N-CA 123.732 2.954 . . . . 0.0 113.075 -179.772 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.511 0 N-CA-C 111.029 -0.829 . . . . 0.0 111.029 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.0 m -137.46 132.77 33.83 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.092 1.357 . . . . 0.0 111.424 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 8.2 t-160 -153.91 117.37 4.62 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.659 1.183 . . . . 0.0 110.754 -178.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 1.7 mmt -135.95 67.34 1.47 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.301 1.44 . . . . 0.0 111.765 -175.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -114.68 -12.82 12.14 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -179.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 62.9 m -55.97 -29.34 60.08 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 126.722 2.009 . . . . 0.0 115.033 -173.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.0 mtm -87.17 -12.53 46.66 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.014 1.326 . . . . 0.0 114.002 -172.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -112.66 -26.93 8.38 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.305 1.842 . . . . 0.0 111.952 178.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -70.5 -31.06 68.01 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 126.007 1.723 . . . . 0.0 113.06 175.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 80.7 mt -103.57 168.83 8.9 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.956 1.302 . . . . 0.0 112.622 -172.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 44.7 m-20 59.02 19.86 7.66 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 126.567 1.947 . . . . 0.0 115.332 -178.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -92.92 23.42 4.23 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.166 1.787 . . . . 0.0 114.205 -177.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 33.3 mm -61.91 -32.03 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.721 1.208 . . . . 0.0 113.25 -165.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.2 mt -125.98 65.79 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 125.163 1.385 . . . . 0.0 109.549 -178.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -126.95 -26.57 3.14 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 114.927 1.454 . . . . 0.0 114.927 -177.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -152.6 -60.14 0.15 Allowed 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 119.266 0.939 . . . . 0.0 113.529 -175.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.282 0.5 OUTLIER 62.43 124.33 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 130.243 3.417 . . . . 0.0 114.072 -176.324 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -131.92 35.89 3.72 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 125.19 1.396 . . . . 0.0 112.256 -177.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -63.08 -21.39 66.14 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.607 0.763 . . . . 0.0 111.49 160.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -148.04 141.18 25.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.906 1.682 . . . . 0.0 112.344 174.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -161.6 -88.06 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.92 1.688 . . . . 0.0 111.442 176.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 88.0 mt -131.4 10.81 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 126.857 2.063 . . . . 0.0 111.229 -168.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -91.26 -1.11 57.75 Favored 'General case' 0 CA--C 1.545 0.776 0 O-C-N 120.194 -1.566 . . . . 0.0 114.028 -172.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 31.3 t -118.23 -50.02 2.47 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.648 1.179 . . . . 0.0 112.717 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.5 p-10 -61.42 -28.45 69.27 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.612 1.338 . . . . 0.0 114.612 177.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.5 t -85.38 -27.16 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.455 1.502 . . . . 0.0 112.035 175.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.0 t -110.99 60.57 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.751 1.621 . . . . 0.0 110.194 -174.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.1 mt -135.84 178.3 7.16 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.633 1.973 . . . . 0.0 111.404 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.4 ttpt 59.07 47.04 12.5 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.815 1.646 . . . . 0.0 113.54 -177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 t30 48.93 65.88 6.49 Favored Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 126.568 1.947 . . . . 0.0 113.247 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -78.79 77.41 4.08 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 124.025 3.15 . . . . 0.0 112.066 -169.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -129.42 -52.6 1.18 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.832 1.253 . . . . 0.0 114.089 -176.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.7 t 34.67 76.55 0.42 Allowed Pre-proline 0 N--CA 1.48 1.057 0 C-N-CA 127.871 2.469 . . . . 0.0 113.103 -179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -64.03 162.4 29.51 Favored 'Trans proline' 0 C--N 1.349 0.58 0 C-N-CA 122.418 2.078 . . . . 0.0 113.462 179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 12.2 p -117.17 55.81 0.83 Allowed 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.015 1.726 . . . . 0.0 112.943 -161.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.404 ' H ' ' CD ' ' A' ' 30' ' ' GLN . 3.3 pm0 -76.38 27.38 0.12 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.151 1.538 . . . . 0.0 115.151 179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 24.75 1.48 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.808 2.043 . . . . 0.0 113.326 -175.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 62.48 -2.96 0.31 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 129.804 3.242 . . . . 0.0 116.7 174.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.29 -36.47 12.59 Favored Glycine 0 CA--C 1.534 1.24 0 C-N-CA 123.736 0.684 . . . . 0.0 113.756 -165.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -87.56 -45.97 9.98 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.686 0.794 . . . . 0.0 111.668 177.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp -121.32 117.63 27.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 128.026 2.53 . . . . 0.0 109.287 173.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 33.3 t -105.21 -70.82 0.76 Allowed 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 125.272 1.429 . . . . 0.0 110.995 168.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -163.82 -43.34 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 123.715 0.806 . . . . 0.0 110.715 -175.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -78.8 10.82 3.0 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.278 1.431 . . . . 0.0 112.799 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -111.89 -46.95 3.18 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.793 1.237 . . . . 0.0 112.482 175.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 12.6 ptpt -67.44 -25.67 66.02 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.746 -1.221 . . . . 0.0 112.641 175.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -65.88 -10.63 40.16 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.491 1.517 . . . . 0.0 113.713 168.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 3.3 mp -98.43 -57.01 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 C-N-CA 125.158 1.383 . . . . 0.0 110.226 165.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.2 t -71.27 -49.45 47.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 120.064 1.302 . . . . 0.0 112.955 -168.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.1 87.33 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.757 0.708 . . . . 0.0 110.98 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -59.89 -38.54 82.56 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 171.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -74.21 -34.57 63.76 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.928 0.891 . . . . 0.0 112.346 179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.4 mp -59.99 -36.04 64.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 121.227 -0.921 . . . . 0.0 111.239 170.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 70.9 m -73.42 -13.41 61.07 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 114.368 1.247 . . . . 0.0 114.368 172.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -100.8 -40.41 7.33 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.767 1.167 . . . . 0.0 112.323 -172.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.8 m -134.62 -22.47 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 -175.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 93.71 135.62 7.66 Favored Glycine 0 CA--C 1.527 0.842 0 CA-C-N 119.619 1.099 . . . . 0.0 111.772 -172.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.15 -25.02 1.3 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 128.167 2.587 . . . . 0.0 114.869 176.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -89.05 -14.86 35.42 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.158 1.383 . . . . 0.0 113.66 -178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -114.66 -21.53 10.19 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.863 1.265 . . . . 0.0 113.47 -172.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.2 169.99 11.0 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.626 1.171 . . . . 0.0 112.738 171.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.5 p30 -113.25 168.95 9.3 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 122.036 0.922 . . . . 0.0 111.387 169.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.03 -23.45 35.9 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.217 1.007 . . . . 0.0 112.702 178.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 m -61.53 -44.62 96.72 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.941 1.696 . . . . 0.0 112.254 -179.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -65.7 -34.04 77.28 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.652 -1.28 . . . . 0.0 112.763 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -67.54 -51.43 50.89 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.514 0.597 . . . . 0.0 111.483 172.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 78.4 p -61.98 -18.15 59.44 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -84.19 -32.28 24.66 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.82 1.248 . . . . 0.0 112.826 177.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -102.69 -36.08 8.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 125.016 1.326 . . . . 0.0 113.205 -175.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.16 -16.2 41.2 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.679 1.192 . . . . 0.0 113.197 174.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.25 47.63 13.87 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-O 122.78 1.276 . . . . 0.0 111.628 -179.001 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.7 pt -110.82 160.0 10.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 127.969 2.507 . . . . 0.0 109.795 175.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.2 t -68.25 152.04 46.05 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.496 -0.753 . . . . 0.0 110.809 167.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.8 t -58.09 -36.67 57.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.001 0.92 . . . . 0.0 111.287 -176.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -69.53 -32.25 70.96 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.947 1.092 . . . . 0.0 113.947 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -67.91 -38.87 83.49 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 118.521 -0.752 . . . . 0.0 110.787 170.146 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.27 -48.79 71.97 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.628 0.649 . . . . 0.0 110.471 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -54.57 -42.34 70.89 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 125.469 1.507 . . . . 0.0 112.746 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -87.43 -33.37 19.1 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 74.8 t80 -64.39 -37.33 87.12 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.802 0.841 . . . . 0.0 112.395 177.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.2 mt -48.03 -50.68 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 124.49 1.116 . . . . 0.0 111.02 174.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -84.64 -30.31 25.0 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -75.85 -24.63 55.77 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 119.769 1.168 . . . . 0.0 113.391 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.2 t -90.09 -32.84 16.52 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.246 1.018 . . . . 0.0 113.47 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -151.78 62.65 0.86 Allowed 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -176.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 54.3 ttt-85 -56.03 -39.06 71.39 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 64.4 mtt -136.92 -37.15 0.66 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.649 1.58 . . . . 0.0 112.431 175.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -177.16 95.82 0.1 Allowed Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.317 0.961 . . . . 0.0 112.487 175.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 47.24 33.89 2.8 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 126.505 1.922 . . . . 0.0 113.9 -178.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m 47.33 33.79 2.85 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.935 2.094 . . . . 0.0 112.825 -174.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 54.8 31.19 15.08 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.788 2.035 . . . . 0.0 113.955 -177.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -90.65 -10.82 41.8 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -175.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -76.01 9.83 2.23 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.186 1.794 . . . . 0.0 115.611 -162.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -11.05 58.77 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.421 1.888 . . . . 0.0 114.461 -177.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 89.5 m -138.15 -41.99 0.52 Allowed 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.59 1.556 . . . . 0.0 111.012 -162.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.7 pt -68.03 171.57 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 C-N-CA 123.786 0.834 . . . . 0.0 111.349 171.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? 66.76 -20.18 0.11 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 127.033 2.133 . . . . 0.0 116.054 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 -9.71 11.18 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 -179.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.2 t80 -111.7 -28.81 7.95 Favored 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 -166.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -83.93 154.72 23.22 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.492 1.117 . . . . 0.0 112.315 177.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -94.49 145.68 24.63 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.844 1.258 . . . . 0.0 112.021 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -118.1 142.54 47.31 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.16 1.384 . . . . 0.0 112.239 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.9 t -122.69 -45.43 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.791 1.236 . . . . 0.0 111.471 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.1 m -121.51 15.2 11.17 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.122 1.369 . . . . 0.0 113.532 -178.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t -141.03 28.34 1.91 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.578 1.551 . . . . 0.0 113.382 -175.44 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -90.86 154.58 19.39 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.751 1.221 . . . . 0.0 112.51 177.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.7 m -137.76 176.88 8.31 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.96 1.704 . . . . 0.0 110.719 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.71 -15.76 54.29 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 178.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -144.05 154.96 58.76 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 126.985 2.114 . . . . 0.0 111.706 168.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -81.68 56.38 5.9 Favored 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 124.434 3.423 . . . . 0.0 112.258 -177.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.0 t-20 -130.94 71.04 1.46 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.395 1.478 . . . . 0.0 110.878 -177.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 16.3 tp -143.06 135.65 13.53 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.875 1.67 . . . . 0.0 109.754 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 C--O 1.25 1.107 0 C-N-CA 123.32 2.68 . . . . 0.0 112.742 -179.942 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 112.145 -0.382 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 8.3 t -147.48 157.76 43.71 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.201 1.4 . . . . 0.0 111.604 176.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -148.1 121.09 8.8 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.912 1.285 . . . . 0.0 111.074 178.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 94.3 mtp -138.02 35.64 2.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.02 1.328 . . . . 0.0 112.789 -177.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -76.77 -61.14 2.07 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.612 0.765 . . . . 0.0 112.392 -177.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 17.8 m 48.64 29.46 2.16 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 127.381 2.272 . . . . 0.0 117.132 171.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 41.2 mtt -150.33 -40.1 0.13 Allowed 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.296 1.438 . . . . 0.0 113.355 -177.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -88.32 -4.35 58.7 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.037 1.335 . . . . 0.0 112.919 -174.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.06 20.36 1.6 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 125.009 1.324 . . . . 0.0 113.021 -162.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mp -138.86 145.25 39.77 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.597 1.159 . . . . 0.0 112.069 174.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -147.01 -20.33 0.4 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.509 1.924 . . . . 0.0 113.016 176.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -81.12 39.61 0.51 Allowed 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 127.294 2.238 . . . . 0.0 114.009 -173.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.1 mt -104.1 113.89 42.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 C-N-CA 125.537 1.535 . . . . 0.0 109.452 -175.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.5 mp -130.93 -53.1 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 125.057 1.343 . . . . 0.0 110.388 177.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -127.77 118.6 24.05 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.149 1.38 . . . . 0.0 110.144 174.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -155.59 -171.69 3.87 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.545 1.538 . . . . 0.0 110.47 177.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.7 tt -124.68 126.3 71.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 127.271 2.228 . . . . 0.0 109.513 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -153.92 178.46 9.9 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.989 2.116 . . . . 0.0 111.883 -173.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -75.1 68.33 1.87 Allowed 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 125.494 1.518 . . . . 0.0 112.047 177.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -90.56 24.84 2.49 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.433 1.893 . . . . 0.0 114.791 -175.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.63 -70.16 0.23 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.166 1.786 . . . . 0.0 113.647 -176.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 92.9 mt -131.67 9.72 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.837 1.655 . . . . 0.0 111.229 -171.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -90.51 -5.13 56.38 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.446 -1.409 . . . . 0.0 113.5 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.3 p -113.17 -55.04 2.57 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.466 1.506 . . . . 0.0 112.604 -173.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 47.1 p-10 -58.87 -24.71 62.53 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 126.201 1.801 . . . . 0.0 114.965 178.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 75.1 t -84.85 -20.27 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 126.04 1.736 . . . . 0.0 112.25 175.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.7 t -128.96 61.84 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 125.636 1.574 . . . . 0.0 110.31 -171.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.2 mt -136.57 163.25 30.98 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.798 1.639 . . . . 0.0 112.682 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -99.11 36.74 1.65 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 126.843 2.057 . . . . 0.0 112.483 -174.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.1 t30 50.83 60.93 14.14 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 126.662 1.985 . . . . 0.0 114.172 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -72.25 87.64 0.89 Allowed 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.702 2.935 . . . . 0.0 112.531 -175.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 -132.94 -58.3 0.91 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.379 1.472 . . . . 0.0 113.639 176.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 26.5 t 40.06 79.81 0.31 Allowed Pre-proline 0 N--CA 1.479 1.022 0 C-N-CA 127.679 2.392 . . . . 0.0 113.301 -177.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -68.64 165.78 28.24 Favored 'Trans proline' 0 CA--C 1.536 0.586 0 C-N-CA 122.935 2.424 . . . . 0.0 113.982 -178.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.2 p -117.71 59.15 0.79 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 125.745 1.618 . . . . 0.0 113.027 -157.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -98.99 18.49 17.13 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -171.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.68 19.55 0.14 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.165 2.186 . . . . 0.0 114.976 -170.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.3 t -147.13 2.17 0.77 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.397 1.879 . . . . 0.0 113.172 -171.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -93.37 -63.71 1.07 Allowed Glycine 0 CA--C 1.533 1.177 0 C-N-CA 124.848 1.213 . . . . 0.0 114.043 -174.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -82.94 -26.83 31.04 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 -168.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.2 mp -139.51 134.75 32.68 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.63 1.572 . . . . 0.0 110.14 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 51.1 m -119.24 -68.12 0.94 Allowed 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.428 1.891 . . . . 0.0 112.415 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -164.56 -39.33 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -173.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -67.84 -29.94 69.2 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 123.437 0.695 . . . . 0.0 110.714 171.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -75.2 -35.49 61.5 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.153 0.981 . . . . 0.0 111.909 -173.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -66.58 -36.64 83.11 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 121.244 -0.91 . . . . 0.0 112.874 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.49 -4.68 2.03 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 114.167 1.173 . . . . 0.0 114.167 170.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.3 mt -109.78 -52.6 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 125.415 1.486 . . . . 0.0 110.816 168.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.5 t -68.06 -63.59 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.738 0.815 . . . . 0.0 111.563 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.53 -29.88 69.39 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.098 0.559 . . . . 0.0 111.583 -175.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -58.03 -37.23 73.95 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 168.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -74.62 -35.52 62.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.884 1.274 . . . . 0.0 111.789 173.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.2 mm -61.17 -34.54 60.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 O-C-N 120.069 -1.644 . . . . 0.0 110.566 173.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.1 m -78.7 -1.97 37.04 Favored 'General case' 0 CA--C 1.546 0.789 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 169.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -101.28 -45.5 5.32 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 120.013 1.279 . . . . 0.0 112.55 -176.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.5 m -131.95 -12.37 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.404 0 N-CA-C 115.61 1.707 . . . . 0.0 115.61 -170.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.4 -78.51 0.36 Allowed Glycine 0 N--CA 1.469 0.845 0 C-N-CA 125.161 1.363 . . . . 0.0 111.971 166.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.5 tt -161.19 -48.92 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.762 1.225 . . . . 0.0 112.066 172.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -95.71 -17.93 20.88 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.202 1.801 . . . . 0.0 114.391 -171.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.9 m-80 -85.73 -14.29 45.78 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 -167.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -67.37 170.77 6.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.656 1.583 . . . . 0.0 112.761 168.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.6 p30 -124.42 166.22 16.36 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.558 1.17 . . . . 0.0 112.659 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.54 -28.62 56.37 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.134 1.374 . . . . 0.0 112.551 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -64.44 -46.05 84.86 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.388 1.475 . . . . 0.0 112.039 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -61.44 -50.87 71.04 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.628 0.771 . . . . 0.0 111.597 175.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 54.0 mt -54.51 -42.32 70.68 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.563 -0.711 . . . . 0.0 111.63 176.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 57.6 m -60.84 -28.65 68.99 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.209 1.403 . . . . 0.0 113.876 175.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -85.92 -31.44 22.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.237 1.415 . . . . 0.0 112.588 -177.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -96.68 -33.54 11.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.448 1.099 . . . . 0.0 113.009 -178.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 18.9 mt -89.8 -17.1 28.81 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.925 1.29 . . . . 0.0 113.479 175.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 61.54 54.33 3.08 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 122.843 1.306 . . . . 0.0 112.684 -175.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.2 pt -119.26 164.96 15.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 126.923 2.089 . . . . 0.0 110.379 175.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.42 HG23 ' H ' ' A' ' 70' ' ' LYS . 8.9 t -74.28 147.99 41.84 Favored 'General case' 0 N--CA 1.473 0.675 0 O-C-N 121.796 -0.565 . . . . 0.0 110.866 166.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 24.3 t -54.49 -30.66 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 125.134 1.374 . . . . 0.0 111.08 176.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -73.55 -27.04 61.13 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.42 ' H ' HG23 ' A' ' 67' ' ' THR . 4.1 mtmp? -81.33 -32.71 32.89 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 119.361 0.982 . . . . 0.0 111.15 167.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.42 74.51 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.969 0.804 . . . . 0.0 111.462 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -68.16 -25.96 65.52 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -94.4 -33.39 13.17 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 176.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -57.56 -44.22 85.11 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 121.214 -0.929 . . . . 0.0 111.852 175.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 46.8 mt -47.3 -60.72 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.989 1.316 . . . . 0.0 110.631 176.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -77.21 -18.65 57.55 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -175.027 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -82.72 -35.89 26.28 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 119.583 1.083 . . . . 0.0 112.648 174.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 67.9 m -95.72 -19.22 19.85 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -175.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -145.4 66.24 1.23 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.557 1.143 . . . . 0.0 112.528 173.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 14.6 tpt180 -67.71 -47.17 70.12 Favored 'General case' 0 N--CA 1.478 0.961 0 O-C-N 121.198 -0.939 . . . . 0.0 113.399 -178.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 64.6 mtt -116.39 -31.71 5.51 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.014 1.326 . . . . 0.0 112.973 -175.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.37 -66.39 0.04 OUTLIER Glycine 0 N--CA 1.469 0.875 0 N-CA-C 110.472 -1.051 . . . . 0.0 110.472 173.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 4.0 mpt_? -121.2 -97.04 0.46 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.087 1.355 . . . . 0.0 109.102 162.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 77.7 p -140.33 30.7 1.94 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 125.053 1.341 . . . . 0.0 113.535 -165.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 21.9 m120 60.94 16.65 7.13 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 115.292 1.59 . . . . 0.0 115.292 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.7 p30 -76.76 -8.71 57.81 Favored 'General case' 0 CA--C 1.549 0.922 0 O-C-N 120.643 -1.286 . . . . 0.0 114.196 178.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.6 p90 -70.38 13.45 0.17 Allowed 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 125.815 1.646 . . . . 0.0 114.262 176.033 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -85.67 -12.54 51.03 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.601 2.36 . . . . 0.0 112.878 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 36.3 m -130.42 -42.6 1.18 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.204 1.802 . . . . 0.0 111.269 -176.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 34.2 mt -71.46 156.45 7.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.312 1.045 . . . . 0.0 108.34 166.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.1 ttmt 65.01 -6.1 0.36 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 117.368 2.358 . . . . 0.0 117.368 171.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -83.6 -28.91 28.17 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 119.486 1.039 . . . . 0.0 113.391 175.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.7 p90 -108.62 -14.87 14.54 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.901 1.281 . . . . 0.0 113.43 -176.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -90.6 163.76 14.44 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.239 1.815 . . . . 0.0 112.501 -174.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.9 t70 56.63 -152.04 0.4 Allowed 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 125.099 1.36 . . . . 0.0 112.73 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 62.0 m-20 -75.54 126.77 31.66 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.367 -1.458 . . . . 0.0 111.412 174.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.2 t -124.9 -41.74 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 124.642 1.177 . . . . 0.0 112.183 -178.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.5 t -130.37 33.42 4.31 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.9 1.28 . . . . 0.0 112.544 -179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t 54.09 43.9 30.03 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.613 1.565 . . . . 0.0 113.753 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -82.45 171.58 13.98 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.266 1.427 . . . . 0.0 113.432 -177.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.0 m -146.66 137.07 23.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.788 1.635 . . . . 0.0 109.83 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 51.86 37.22 20.15 Favored 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 124.488 1.115 . . . . 0.0 113.707 -173.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -121.24 82.0 37.78 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 125.814 1.645 . . . . 0.0 111.941 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.0 96.64 0.95 Allowed 'Trans proline' 0 CA--C 1.54 0.824 0 C-N-CA 123.778 2.985 . . . . 0.0 111.464 178.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -103.01 59.91 0.77 Allowed 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 125.415 1.486 . . . . 0.0 111.556 -173.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.1 tt -134.75 72.94 68.19 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.69 1.196 . . . . 0.0 110.91 -178.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo . . . . . 0 C--O 1.253 1.231 0 C-N-CA 124.016 3.144 . . . . 0.0 113.368 176.417 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.546 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 53.0 m -131.5 142.25 49.92 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 125.303 1.441 . . . . 0.0 111.49 -178.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -147.32 115.33 6.52 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.285 1.034 . . . . 0.0 110.36 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 61.5 mtt -137.17 67.35 1.44 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.313 1.445 . . . . 0.0 110.829 -177.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -135.46 -48.47 0.71 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 124.53 1.132 . . . . 0.0 113.079 -179.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 13.4 t 63.69 -52.04 0.24 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 128.747 2.819 . . . . 0.0 115.609 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.4 mtt -87.03 -19.32 28.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.72 1.208 . . . . 0.0 114.138 -169.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -93.04 1.12 57.42 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.003 1.721 . . . . 0.0 113.473 -174.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.8 pp0? -127.28 28.22 5.76 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.588 1.555 . . . . 0.0 113.927 -171.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 65.6 mt -103.52 -63.83 1.15 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.829 1.252 . . . . 0.0 112.89 -174.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -136.48 -1.34 2.32 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.687 1.195 . . . . 0.0 114.021 -174.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -98.69 78.55 2.36 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 124.495 1.118 . . . . 0.0 112.318 -176.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.3 mp -128.19 77.71 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 123.804 0.842 . . . . 0.0 110.199 178.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.8 mt -135.03 140.32 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 126.465 1.906 . . . . 0.0 109.063 -176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 57.64 -178.0 0.06 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.222 1.809 . . . . 0.0 114.313 -172.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -119.82 145.66 46.43 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.497 1.519 . . . . 0.0 112.091 -174.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 46.4 pt -115.15 41.26 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 125.969 1.708 . . . . 0.0 113.359 -164.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -78.02 170.44 16.59 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.431 1.492 . . . . 0.0 112.48 178.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.9 ttmt -73.75 54.7 0.5 Allowed 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 126.159 1.784 . . . . 0.0 113.148 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -131.15 134.19 46.29 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.578 1.551 . . . . 0.0 111.383 175.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -146.09 -80.11 0.16 Allowed 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.894 1.278 . . . . 0.0 112.125 172.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 96.1 mt -125.09 7.18 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 125.606 1.563 . . . . 0.0 111.987 -172.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.8 m-20 -90.23 -4.23 57.34 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.539 -1.35 . . . . 0.0 113.583 -177.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 30.3 p -112.61 -59.17 2.05 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.545 1.538 . . . . 0.0 111.826 -174.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -57.75 -25.43 60.43 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.328 1.851 . . . . 0.0 115.313 178.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 85.9 t -87.86 -21.47 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 125.941 1.696 . . . . 0.0 112.001 176.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.7 t -126.76 61.09 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 125.885 1.674 . . . . 0.0 110.252 -170.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.0 mt -106.57 154.8 20.37 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.835 1.654 . . . . 0.0 112.383 178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -119.42 34.93 5.02 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.797 1.639 . . . . 0.0 113.03 -173.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 t30 50.21 68.28 3.58 Favored Pre-proline 0 CA--C 1.556 1.2 0 C-N-CA 126.994 2.118 . . . . 0.0 113.566 -179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -75.43 83.12 1.94 Allowed 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 123.779 2.986 . . . . 0.0 112.417 -174.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? 47.45 53.38 11.09 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 126.143 1.777 . . . . 0.0 112.907 176.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 61.4 t 52.35 88.99 0.11 Allowed Pre-proline 0 N--CA 1.479 1.011 0 C-N-CA 128.158 2.583 . . . . 0.0 112.617 -179.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.06 163.3 36.43 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.914 2.409 . . . . 0.0 114.32 -177.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.4 p -115.07 64.92 0.68 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 126.347 1.859 . . . . 0.0 112.876 -161.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -83.82 48.42 1.44 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.566 1.147 . . . . 0.0 113.24 -175.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -75.48 54.48 0.75 Allowed 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.953 2.101 . . . . 0.0 111.876 174.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.8 t -113.19 3.48 16.05 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 126.283 1.833 . . . . 0.0 113.898 -171.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.46 -24.73 71.05 Favored Glycine 0 CA--C 1.538 1.476 0 C-N-CA 124.904 1.24 . . . . 0.0 116.058 -167.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -124.22 5.75 8.48 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.63 1.172 . . . . 0.0 113.487 175.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.39 99.67 4.16 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.521 1.129 . . . . 0.0 113.218 -172.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.1 m -147.58 90.17 1.83 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.163 2.185 . . . . 0.0 111.322 -171.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 65.84 5.74 3.59 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 161.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -128.49 -38.55 1.73 Allowed 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 124.719 1.207 . . . . 0.0 111.05 172.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -74.74 -32.95 62.26 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.149 1.38 . . . . 0.0 111.942 -173.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -67.9 -36.41 80.16 Favored 'General case' 0 N--CA 1.474 0.757 0 O-C-N 121.299 -0.875 . . . . 0.0 112.241 171.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.6 mttt -63.29 -4.98 2.92 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.619 1.34 . . . . 0.0 114.619 170.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.2 mt -109.54 -15.8 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.052 1.741 . . . . 0.0 112.563 174.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 23.0 t -128.78 -55.86 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 CA-C-N 119.316 0.962 . . . . 0.0 112.904 -172.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -61.73 -40.67 95.9 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.643 1.11 . . . . 0.0 111.124 173.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -66.49 -27.53 67.86 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 172.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.11 -38.48 56.86 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.303 1.041 . . . . 0.0 111.682 175.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.64 -34.28 54.67 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.826 -1.171 . . . . 0.0 110.642 169.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 67.3 m -72.44 -10.84 60.29 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -106.78 -42.35 4.97 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.423 1.465 . . . . 0.0 112.894 -173.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -127.18 -14.88 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 114.525 1.306 . . . . 0.0 114.525 -173.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.07 -79.67 0.35 Allowed Glycine 0 N--CA 1.468 0.768 0 C-N-CA 125.373 1.463 . . . . 0.0 112.044 165.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.4 tt -164.05 -46.65 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.945 1.298 . . . . 0.0 112.042 177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -98.79 -17.2 18.6 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 126.316 1.846 . . . . 0.0 114.531 -172.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -87.15 -14.5 41.07 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -169.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -68.78 165.98 18.51 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.342 1.457 . . . . 0.0 112.085 166.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -119.81 169.62 9.97 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-O 122.284 1.04 . . . . 0.0 111.831 173.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.66 -23.18 42.68 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.388 1.075 . . . . 0.0 112.824 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.3 m -67.41 -46.25 73.73 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.827 1.651 . . . . 0.0 112.15 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.9 mm-40 -67.16 -29.87 69.68 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 120.453 -1.405 . . . . 0.0 112.829 177.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 mp -67.83 -54.56 18.1 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.429 1.091 . . . . 0.0 112.031 167.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 91.3 p -60.63 -30.17 69.7 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.732 0.813 . . . . 0.0 112.989 -177.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -69.34 -45.12 70.2 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.374 1.47 . . . . 0.0 113.388 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 75.8 mtt85 -95.6 -36.74 11.14 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.23 -15.65 46.09 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.431 1.493 . . . . 0.0 111.18 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.99 60.2 2.2 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.229 1.812 . . . . 0.0 112.155 175.15 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.0 pt -128.88 162.15 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 128.209 2.603 . . . . 0.0 109.408 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.418 HG23 ' H ' ' A' ' 70' ' ' LYS . 12.8 t -68.29 151.5 46.82 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.499 -0.75 . . . . 0.0 110.666 167.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -58.7 -36.03 58.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.84 0.856 . . . . 0.0 111.007 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.43 -32.59 73.57 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 177.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.418 ' H ' HG23 ' A' ' 67' ' ' THR . 58.6 mttt -66.4 -37.52 85.42 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 118.6 -0.714 . . . . 0.0 111.064 170.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.97 -48.83 62.19 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 118.791 0.723 . . . . 0.0 110.28 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.9 mtpt -56.52 -35.28 67.9 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.845 1.658 . . . . 0.0 113.403 178.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.1 t -86.95 -43.03 12.7 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.933 0.788 . . . . 0.0 112.634 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -59.43 -37.58 78.45 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 119.735 1.152 . . . . 0.0 113.142 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 44.2 mt -47.49 -57.05 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.544 1.137 . . . . 0.0 110.882 173.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.2 pttm -78.88 -35.13 44.15 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -65.74 -30.02 70.62 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 119.149 0.886 . . . . 0.0 112.739 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.4 t -78.19 -43.25 29.05 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.448 1.099 . . . . 0.0 112.708 171.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -149.09 84.15 1.45 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.524 1.13 . . . . 0.0 113.033 -175.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 78.4 mtt180 -63.14 -46.75 85.75 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.103 0.961 . . . . 0.0 112.97 175.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 17.0 mmt -116.41 -13.82 10.98 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 126.016 1.726 . . . . 0.0 113.662 -177.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 109.79 -50.77 0.75 Allowed Glycine 0 N--CA 1.473 1.124 0 C-N-CA 125.65 1.595 . . . . 0.0 112.632 176.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.1 mtp85 -111.53 30.92 6.53 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.586 1.554 . . . . 0.0 113.158 178.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.3 m 50.41 32.85 6.88 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.849 2.059 . . . . 0.0 113.295 -178.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 55.98 9.93 0.52 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 126.71 2.004 . . . . 0.0 115.728 -172.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.36 10.05 37.68 Favored 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 125.316 1.446 . . . . 0.0 114.246 -169.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.6 p90 -68.75 18.18 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 127.036 2.134 . . . . 0.0 114.717 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 37.9 mttm -76.97 -25.96 53.39 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 127.32 2.248 . . . . 0.0 111.474 -177.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 86.1 m -131.11 -42.98 1.07 Allowed 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 126.892 2.077 . . . . 0.0 111.367 -169.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 mt -76.22 159.21 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.54 1.136 . . . . 0.0 108.859 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 66.93 -22.81 0.11 Allowed 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 127.559 2.344 . . . . 0.0 116.227 179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -23.48 26.52 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 119.798 1.181 . . . . 0.0 114.079 -168.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -107.87 -11.09 15.42 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 114.344 1.238 . . . . 0.0 114.344 177.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -92.15 5.78 49.07 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 114.287 1.217 . . . . 0.0 114.287 -171.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -84.58 47.34 1.35 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.679 1.592 . . . . 0.0 113.604 -170.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -73.61 139.83 45.77 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.455 1.102 . . . . 0.0 112.376 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 50.3 t -135.05 -51.52 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.723 1.209 . . . . 0.0 111.802 177.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 60.0 p -117.25 19.66 14.03 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.82 1.648 . . . . 0.0 113.634 -173.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.0 t 55.94 43.47 27.32 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 125.144 1.378 . . . . 0.0 112.754 -171.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -133.49 161.91 33.3 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.374 1.869 . . . . 0.0 111.679 -179.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.1 t -128.94 167.69 17.07 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.274 1.43 . . . . 0.0 112.184 -177.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -78.55 31.09 0.19 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 126.638 1.975 . . . . 0.0 114.002 -175.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 49.57 66.57 5.46 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 127.072 2.149 . . . . 0.0 113.036 178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -65.05 101.2 0.39 Allowed 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 124.108 3.205 . . . . 0.0 111.742 -177.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -145.77 47.22 1.26 Allowed 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 125.78 1.632 . . . . 0.0 110.896 -175.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 2.5 tt -127.73 71.27 77.86 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 125.344 1.458 . . . . 0.0 110.312 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.258 0 C-N-CA 124.044 3.163 . . . . 0.0 113.141 179.589 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.551 0 N-CA-C 111.631 -0.587 . . . . 0.0 111.631 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 79.0 p -145.83 160.71 41.39 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.463 1.505 . . . . 0.0 112.196 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 7.2 t60 -142.79 110.3 5.77 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.615 1.166 . . . . 0.0 110.876 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 59.5 mtt -142.79 59.06 1.43 Allowed 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.49 1.516 . . . . 0.0 110.621 179.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -129.25 26.31 5.44 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.204 1.401 . . . . 0.0 113.79 -173.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 35.9 m -112.52 16.98 19.62 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -158.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ptm -150.77 -13.07 0.23 Allowed 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 -176.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -132.17 7.1 4.25 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.221 1.408 . . . . 0.0 112.851 -174.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.67 29.06 1.75 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.554 1.942 . . . . 0.0 110.781 -172.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -101.32 93.27 5.34 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.47 1.508 . . . . 0.0 110.052 -179.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -144.48 102.14 3.78 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 126.595 1.958 . . . . 0.0 107.176 176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -74.75 145.62 42.86 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.268 0.627 . . . . 0.0 111.427 170.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -134.89 43.83 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.446 1.099 . . . . 0.0 110.914 -168.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 55.8 mt -111.18 95.43 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.529 1.532 . . . . 0.0 109.63 -173.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.6 mp0 -123.27 78.31 1.56 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.339 1.456 . . . . 0.0 110.454 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -134.23 9.45 3.77 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 115.122 1.527 . . . . 0.0 115.122 -178.105 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 20.7 pt -117.01 78.65 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 125.71 1.604 . . . . 0.0 111.981 -171.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -134.21 34.19 3.31 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.539 1.535 . . . . 0.0 113.946 -173.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt 53.35 41.89 32.08 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.771 1.629 . . . . 0.0 113.738 174.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.253 2.5 mt-10 58.41 26.95 14.77 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 174.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.35 12.61 0.43 Allowed 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 116.914 2.191 . . . . 0.0 116.914 -170.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.7 mp -115.15 7.1 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 C-N-CA 127.092 2.157 . . . . 0.0 112.225 -179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -86.07 -10.19 55.38 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 120.386 -1.446 . . . . 0.0 114.184 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.8 t -114.42 -48.82 2.86 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.749 1.22 . . . . 0.0 112.449 -170.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -59.47 -22.3 61.33 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.7 p -107.52 -6.09 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.972 1.709 . . . . 0.0 113.344 -178.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.0 t -133.5 57.4 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 125.828 1.651 . . . . 0.0 110.332 -178.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.9 tp -115.51 140.55 49.05 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.966 1.306 . . . . 0.0 111.584 -178.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -128.21 37.25 4.18 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 125.782 1.633 . . . . 0.0 113.02 -176.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.5 t30 49.02 65.84 6.55 Favored Pre-proline 0 CA--C 1.556 1.198 0 C-N-CA 126.37 1.868 . . . . 0.0 113.225 -179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -71.19 86.46 0.78 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 124.007 3.138 . . . . 0.0 112.566 -171.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 35.5 mmt180 -130.56 -42.23 1.17 Allowed 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.021 1.728 . . . . 0.0 113.428 179.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 21.3 t -132.72 86.26 44.7 Favored Pre-proline 0 N--CA 1.48 1.035 0 C-N-CA 124.459 1.104 . . . . 0.0 110.859 -174.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.82 160.57 37.34 Favored 'Trans proline' 0 CA--C 1.537 0.673 0 C-N-CA 123.067 2.511 . . . . 0.0 112.718 173.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.8 p -77.29 60.26 1.94 Allowed 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 127.953 2.501 . . . . 0.0 113.558 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -84.92 18.7 2.35 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 126.366 1.867 . . . . 0.0 115.459 -172.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.29 51.96 2.14 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.944 1.698 . . . . 0.0 113.553 -159.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t -104.48 -10.78 17.43 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -168.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -90.85 -79.79 1.38 Allowed Glycine 0 CA--C 1.533 1.2 0 C-N-CA 125.514 1.53 . . . . 0.0 112.556 179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 63.41 9.11 3.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.155 2.182 . . . . 0.0 116.587 176.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 mp -136.67 122.36 19.8 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.86 1.264 . . . . 0.0 109.782 164.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -129.17 -69.12 0.71 Allowed 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.934 0.893 . . . . 0.0 112.551 -176.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -156.35 -20.35 0.1 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -166.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -93.04 -31.79 14.73 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.328 0.651 . . . . 0.0 111.465 168.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mp0 -79.25 -43.34 23.94 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.413 -0.804 . . . . 0.0 112.626 -166.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 ptpt -69.64 -23.47 63.49 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.26 -0.9 . . . . 0.0 112.533 174.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -68.61 -3.7 12.78 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 164.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -106.01 -50.37 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 C-N-CA 125.173 1.389 . . . . 0.0 109.856 165.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 47.5 t -66.69 -62.2 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.417 1.008 . . . . 0.0 111.558 -174.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.31 -29.75 64.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.907 -0.496 . . . . 0.0 111.944 -175.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -57.15 -39.57 75.49 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 167.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.68 -34.39 64.87 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.221 1.008 . . . . 0.0 112.075 175.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -62.52 -34.26 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 O-C-N 120.656 -1.278 . . . . 0.0 110.081 173.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.4 t -75.32 -10.33 59.37 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 170.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -99.22 -43.9 6.45 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.342 -1.474 . . . . 0.0 112.534 -173.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.4 m -132.51 -11.81 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -171.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.02 -77.73 0.39 Allowed Glycine 0 N--CA 1.471 0.993 0 C-N-CA 125.031 1.3 . . . . 0.0 112.478 165.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 tp -161.88 -44.0 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.763 1.225 . . . . 0.0 112.159 173.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -109.6 -8.35 14.99 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.299 1.439 . . . . 0.0 114.25 -167.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -89.08 -14.24 36.78 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 112.838 -176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -69.36 166.35 18.8 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.065 1.346 . . . . 0.0 112.339 167.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -124.04 165.5 17.37 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 122.585 1.183 . . . . 0.0 112.33 173.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -75.08 -29.55 60.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.592 1.157 . . . . 0.0 112.932 -176.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -65.11 -44.96 87.05 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.454 1.501 . . . . 0.0 111.942 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -64.27 -32.0 73.42 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 120.566 -1.334 . . . . 0.0 112.76 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 tp -72.51 -47.89 44.88 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.302 0.641 . . . . 0.0 111.555 175.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 88.5 p -63.46 -28.68 70.13 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.443 1.097 . . . . 0.0 113.077 178.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -69.71 -37.3 76.5 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.844 1.258 . . . . 0.0 113.34 -179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -104.4 -33.21 8.69 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -175.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.7 tt -84.89 -17.69 37.11 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.685 1.194 . . . . 0.0 111.846 176.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 60.89 69.51 0.67 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 126.43 1.892 . . . . 0.0 112.373 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -134.45 168.9 22.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 127.019 2.127 . . . . 0.0 111.254 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.6 m -69.7 136.92 51.6 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.893 1.277 . . . . 0.0 110.042 166.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.2 t -58.09 -35.48 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.169 0.988 . . . . 0.0 111.832 -178.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -69.95 -26.59 64.19 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 177.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -78.75 -33.36 46.62 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 118.555 -0.736 . . . . 0.0 110.891 169.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.6 -49.47 68.66 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.749 0.704 . . . . 0.0 110.716 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -67.54 -21.04 65.48 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 114.692 1.367 . . . . 0.0 114.692 -175.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.5 t -96.33 -35.13 11.32 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 118.939 0.791 . . . . 0.0 113.047 171.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -57.72 -43.32 85.2 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.874 0.87 . . . . 0.0 111.935 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.2 mt -46.39 -62.51 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.076 1.35 . . . . 0.0 110.653 176.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.2 pttt -81.03 5.34 16.76 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -110.05 -31.24 7.44 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.275 1.03 . . . . 0.0 112.766 169.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.0 t -83.2 -39.26 21.2 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.728 1.211 . . . . 0.0 112.045 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.29 81.98 1.88 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.593 1.557 . . . . 0.0 110.935 175.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -73.52 -31.85 63.91 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.535 1.134 . . . . 0.0 113.589 176.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 23.1 mmt -133.91 -34.16 1.01 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.871 1.668 . . . . 0.0 112.379 172.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 123.52 -93.85 0.48 Allowed Glycine 0 CA--C 1.527 0.835 0 C-N-CA 125.572 1.558 . . . . 0.0 110.299 -177.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 7.0 ttm-85 -79.57 39.43 0.41 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 126.243 1.817 . . . . 0.0 114.106 -177.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.2 m 50.27 29.64 3.88 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 127.965 2.506 . . . . 0.0 114.014 177.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . 0.277 0.7 OUTLIER 47.86 25.05 0.67 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 126.47 1.908 . . . . 0.0 115.324 -170.665 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -94.65 -3.56 49.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.615 1.166 . . . . 0.0 113.71 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 45.1 p90 -75.02 18.77 0.17 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.839 2.056 . . . . 0.0 114.333 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 5.8 mtmp? -68.97 -16.76 63.81 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.543 2.337 . . . . 0.0 114.003 178.276 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 1.5 t -144.11 -19.26 0.57 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.582 1.553 . . . . 0.0 113.19 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 mt -109.98 156.54 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 126.029 1.732 . . . . 0.0 108.896 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 63.3 -0.38 0.67 Allowed 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 115.643 1.72 . . . . 0.0 115.643 -171.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.5 ptm -125.1 -3.04 7.6 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 125.298 1.439 . . . . 0.0 114.5 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -129.28 -19.68 3.46 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -163.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -88.73 153.25 21.24 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.829 1.252 . . . . 0.0 112.371 -179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -146.35 148.72 32.66 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.505 1.522 . . . . 0.0 110.9 176.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -119.53 143.25 47.69 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.168 1.387 . . . . 0.0 112.208 -176.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.9 t -124.07 -46.51 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 124.629 1.172 . . . . 0.0 111.441 -177.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 57.8 p -113.35 2.22 15.41 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.532 1.533 . . . . 0.0 114.34 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.5 m -132.27 18.87 4.43 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.666 1.586 . . . . 0.0 114.206 -172.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.35 162.44 27.89 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.465 1.106 . . . . 0.0 113.394 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 69.8 m -131.04 162.23 30.26 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.819 1.648 . . . . 0.0 111.561 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.03 33.53 0.28 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.829 1.652 . . . . 0.0 113.671 -176.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 33.1 mt-30 47.2 58.98 17.03 Favored Pre-proline 0 CA--C 1.553 1.077 0 C-N-CA 127.508 2.323 . . . . 0.0 114.01 -177.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -76.72 63.65 7.43 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 124.938 3.759 . . . . 0.0 112.48 -177.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -121.7 27.83 7.98 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.79 1.636 . . . . 0.0 112.981 -174.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 6.6 mp -118.62 82.22 19.56 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.074 1.75 . . . . 0.0 109.753 179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.254 1.293 0 C-N-CA 123.853 3.035 . . . . 0.0 113.321 -179.573 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 52.4 m -134.71 160.77 37.12 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.609 1.563 . . . . 0.0 112.049 -177.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 76.2 t60 -130.37 138.88 50.61 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.127 1.371 . . . . 0.0 111.359 177.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.2 mmt -129.12 95.31 4.02 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.937 1.295 . . . . 0.0 110.945 -173.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -142.45 19.57 2.05 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.986 1.314 . . . . 0.0 114.044 -176.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.2 t -96.02 2.54 53.45 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 124.809 1.244 . . . . 0.0 114.339 -173.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -147.86 0.25 0.64 Allowed 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.752 1.76 . . . . 0.0 115.752 -174.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -125.57 3.79 7.58 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.58 1.552 . . . . 0.0 112.854 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.25 34.69 1.2 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.873 1.669 . . . . 0.0 111.247 -165.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -132.05 14.87 4.72 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -169.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -110.66 -56.77 2.31 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.429 1.092 . . . . 0.0 113.604 -176.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -109.66 92.92 4.24 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.716 1.206 . . . . 0.0 110.66 -177.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 32.5 mm -126.82 121.69 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.784 1.634 . . . . 0.0 108.803 178.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 57.9 mt -137.13 127.73 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.373 1.469 . . . . 0.0 108.845 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -136.31 73.43 1.46 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.969 1.308 . . . . 0.0 110.712 -178.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -152.75 -175.04 5.13 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.234 1.414 . . . . 0.0 110.982 -177.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.323 13.1 tt 50.39 39.57 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 C-N-CA 127.534 2.333 . . . . 0.0 114.928 172.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -144.89 -166.24 2.36 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.617 1.167 . . . . 0.0 112.634 -172.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -70.08 88.42 0.59 Allowed 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.393 1.077 . . . . 0.0 110.463 168.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -133.09 138.77 46.83 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.966 2.106 . . . . 0.0 110.162 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -148.88 -84.67 0.1 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.858 1.263 . . . . 0.0 111.316 -177.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.7 mp -127.35 -8.28 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 125.305 1.442 . . . . 0.0 113.618 -178.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -73.39 -9.27 58.52 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 -169.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.2 t -99.77 -56.33 2.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.825 1.25 . . . . 0.0 112.059 174.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -69.76 -16.43 63.31 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -172.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.6 p -75.35 -15.67 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 124.045 0.938 . . . . 0.0 112.93 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.5 t -120.47 71.57 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 125.675 1.59 . . . . 0.0 109.786 176.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.6 tp -140.84 140.68 34.68 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.561 1.144 . . . . 0.0 111.844 -179.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.0 ttmm -121.79 34.14 5.28 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.456 1.902 . . . . 0.0 112.991 -176.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 t30 48.02 64.58 8.35 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 126.346 1.858 . . . . 0.0 113.143 -176.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.76 88.53 0.78 Allowed 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 123.86 3.04 . . . . 0.0 112.405 -173.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -141.66 -53.75 0.45 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 125.431 1.492 . . . . 0.0 113.169 176.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.4 t -135.77 77.94 50.0 Favored Pre-proline 0 N--CA 1.482 1.162 0 C-N-CA 124.274 1.03 . . . . 0.0 111.603 -173.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -82.1 96.77 0.89 Allowed 'Trans proline' 0 CA--C 1.54 0.775 0 C-N-CA 123.22 2.613 . . . . 0.0 111.895 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.1 t -151.3 29.5 0.63 Allowed 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 125.034 1.334 . . . . 0.0 113.757 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -86.06 16.05 4.56 Favored 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 -172.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.39 56.78 3.17 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 127.0 2.12 . . . . 0.0 111.776 -170.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.5 t -132.16 5.58 4.15 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 116.058 1.873 . . . . 0.0 116.058 -161.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 164.07 47.97 0.02 OUTLIER Glycine 0 N--CA 1.476 1.316 0 O-C-N 120.697 -1.252 . . . . 0.0 115.765 178.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -75.06 -48.31 24.57 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 118.46 1.13 . . . . 0.0 113.671 -171.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp -147.3 145.22 29.3 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.423 2.289 . . . . 0.0 108.983 174.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.1 t -140.6 -62.79 0.49 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.769 1.228 . . . . 0.0 114.084 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -161.11 -26.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.714 1.005 . . . . 0.0 113.714 -165.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -105.11 12.26 32.29 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.658 1.583 . . . . 0.0 111.351 176.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.2 mp0 -118.7 -48.98 2.46 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.193 0.997 . . . . 0.0 112.354 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.455 ' HD2' ' H ' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -67.24 -22.71 65.68 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.512 -1.367 . . . . 0.0 112.891 171.381 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.7 mttm -66.47 -11.11 50.59 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 169.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.2 mp -95.01 -60.73 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 125.54 1.536 . . . . 0.0 108.145 169.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.5 t -77.32 -50.77 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 -166.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.28 -25.32 65.09 Favored 'General case' 0 CA--C 1.541 0.598 0 O-C-N 121.563 -0.711 . . . . 0.0 111.924 -179.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -72.97 -35.29 66.87 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.163 1.385 . . . . 0.0 113.313 168.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -66.35 -36.98 84.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.822 -1.174 . . . . 0.0 111.58 174.293 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.18 -21.62 29.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.859 0 O-C-N 121.103 -0.998 . . . . 0.0 111.596 171.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 34.0 m -89.68 -5.32 57.17 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.746 1.219 . . . . 0.0 114.121 169.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -111.62 -33.21 6.42 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.958 1.254 . . . . 0.0 113.243 -173.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -138.11 -14.16 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 114.911 1.448 . . . . 0.0 114.911 -177.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.86 -80.82 0.34 Allowed Glycine 0 N--CA 1.469 0.885 0 C-N-CA 125.135 1.35 . . . . 0.0 112.538 167.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 57.3 tp -168.88 -34.42 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.153 1.781 . . . . 0.0 111.559 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -116.49 -5.07 11.72 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 114.989 1.477 . . . . 0.0 114.989 -165.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 60.4 m-80 -99.41 -18.74 17.33 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 118.603 0.638 . . . . 0.0 112.671 -178.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.0 pp -65.94 158.01 29.21 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.169 1.388 . . . . 0.0 112.227 170.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.8 p30 -113.02 171.17 7.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 122.338 1.066 . . . . 0.0 111.661 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.29 -19.88 30.88 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.609 1.164 . . . . 0.0 112.798 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -67.59 -45.92 74.11 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.031 1.732 . . . . 0.0 112.257 -179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -65.83 -37.91 87.51 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.698 -1.251 . . . . 0.0 111.983 176.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.56 -52.93 62.42 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.69 0.796 . . . . 0.0 111.981 172.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 95.5 p -62.83 -22.69 66.83 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.044 0.938 . . . . 0.0 113.193 -179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.8 mttm -77.84 -42.53 33.33 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.631 1.573 . . . . 0.0 112.598 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -86.55 -38.56 17.06 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.167 0.987 . . . . 0.0 113.231 179.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 53.1 mt -88.51 -17.6 29.96 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.67 1.188 . . . . 0.0 113.186 -175.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 60.21 33.3 21.04 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 125.326 1.45 . . . . 0.0 113.168 -178.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.7 pt -89.86 163.94 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 126.772 2.029 . . . . 0.0 110.46 167.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.438 HG23 ' H ' ' A' ' 70' ' ' LYS . 11.0 t -72.39 151.7 42.48 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 121.578 -0.702 . . . . 0.0 110.926 165.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.4 t -57.4 -35.15 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 124.584 1.153 . . . . 0.0 111.372 -177.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -71.73 -32.57 67.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 113.834 1.05 . . . . 0.0 113.834 178.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.438 ' H ' HG23 ' A' ' 67' ' ' THR . 79.8 mttt -69.15 -36.43 77.41 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.789 169.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.01 -48.6 70.61 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 119.199 0.909 . . . . 0.0 110.705 176.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -54.19 -42.06 69.29 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 126.017 1.727 . . . . 0.0 113.128 178.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.1 t -85.17 -39.53 17.75 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 112.286 0.476 . . . . 0.0 112.286 179.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -59.53 -37.71 79.08 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 120.804 -1.185 . . . . 0.0 112.893 178.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.0 mt -48.2 -42.07 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.57 1.148 . . . . 0.0 111.914 174.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -95.19 -39.33 10.15 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -71.5 -21.05 61.98 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.221 -0.925 . . . . 0.0 113.42 -175.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 11.5 t -89.48 -39.44 13.34 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.015 0.926 . . . . 0.0 113.338 173.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -143.97 54.05 1.3 Allowed 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -169.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 40.4 ttt-85 -55.49 -42.12 73.97 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 126.005 1.722 . . . . 0.0 113.681 -178.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 76.5 mtm -107.53 -13.23 15.12 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.842 1.257 . . . . 0.0 113.83 -179.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 108.51 122.07 4.63 Favored Glycine 0 CA--C 1.527 0.828 0 C-N-CA 125.508 1.528 . . . . 0.0 111.233 175.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 59.6 mtt-85 45.87 42.83 9.49 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.089 1.756 . . . . 0.0 113.329 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 50.58 25.57 2.06 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 128.027 2.531 . . . . 0.0 114.692 -176.477 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.42 27.29 4.79 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.429 1.892 . . . . 0.0 113.757 -172.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.03 -16.41 22.73 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.146 0.978 . . . . 0.0 113.324 -179.295 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.3 p90 -74.38 12.35 0.78 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 126.655 1.982 . . . . 0.0 115.435 -171.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.95 6.5 47.63 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 127.076 2.151 . . . . 0.0 114.795 -167.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 96.8 m -142.88 -46.59 0.31 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.032 1.733 . . . . 0.0 110.135 -175.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 47.7 pt -73.87 170.74 1.37 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.279 1.432 . . . . 0.0 111.955 174.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 64.97 -3.79 0.55 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.613 1.965 . . . . 0.0 116.17 176.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 21.6 ptt? -140.23 18.84 2.42 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.07 1.137 . . . . 0.0 114.07 178.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 45.9 t80 -144.28 -31.83 0.44 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -174.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -68.47 145.87 53.67 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.293 1.437 . . . . 0.0 113.224 175.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -149.44 164.17 35.74 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.357 1.463 . . . . 0.0 113.098 -174.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -134.09 141.33 47.12 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.627 1.571 . . . . 0.0 111.595 177.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.7 t -134.14 -50.72 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 C-N-CA 124.866 1.266 . . . . 0.0 111.546 177.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 70.0 p -113.71 11.8 18.21 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.805 1.642 . . . . 0.0 114.106 -176.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 t 55.15 50.47 15.15 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.618 1.567 . . . . 0.0 113.356 -176.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -123.31 130.89 53.37 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.397 1.479 . . . . 0.0 111.503 178.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 67.2 m -142.37 116.51 9.45 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 125.23 1.412 . . . . 0.0 111.064 -176.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.96 29.22 7.54 Favored 'General case' 0 CA--C 1.552 1.029 0 C-N-CA 125.415 1.486 . . . . 0.0 114.673 -176.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -117.15 153.58 49.79 Favored Pre-proline 0 CA--C 1.547 0.839 0 C-N-CA 126.895 2.078 . . . . 0.0 112.135 -172.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -77.09 80.49 2.86 Favored 'Trans proline' 0 CA--C 1.543 0.934 0 C-N-CA 124.178 3.252 . . . . 0.0 112.112 -175.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 25.8 m120 -129.37 83.53 2.15 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.637 1.575 . . . . 0.0 110.423 -178.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 22.4 tp -138.56 84.07 19.39 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 124.97 1.308 . . . . 0.0 110.593 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--O 1.253 1.275 0 C-N-CA 123.925 3.083 . . . . 0.0 113.288 -178.672 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.472 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 19.8 t -141.56 151.52 43.28 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.348 1.459 . . . . 0.0 111.237 177.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -105.44 99.6 9.21 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.516 1.126 . . . . 0.0 111.088 -174.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 97.4 mmm -124.77 94.58 4.23 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.384 1.474 . . . . 0.0 110.277 -177.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -153.11 -42.3 0.1 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.816 1.247 . . . . 0.0 113.298 -179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 56.6 p 57.01 -42.32 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 131.098 3.759 . . . . 0.0 117.352 -178.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.4 mtm -93.41 -12.03 30.82 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.316 1.446 . . . . 0.0 114.438 -173.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -97.51 4.7 50.34 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.538 1.535 . . . . 0.0 113.692 -177.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -126.5 16.73 7.61 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.258 1.423 . . . . 0.0 114.791 -171.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.3 mp -77.78 66.65 3.5 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.194 1.398 . . . . 0.0 111.159 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -141.54 -10.67 0.93 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.991 1.317 . . . . 0.0 114.208 -176.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -130.5 124.54 32.18 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.99 1.316 . . . . 0.0 111.342 174.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 22.8 mm -129.34 84.47 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 125.808 1.643 . . . . 0.0 107.569 179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.3 mt -128.4 116.66 42.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 125.204 1.402 . . . . 0.0 108.556 -175.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -138.4 115.89 11.27 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.943 1.297 . . . . 0.0 110.292 -177.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -154.64 170.96 20.29 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.995 1.718 . . . . 0.0 111.151 178.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.35 11.4 tt 51.31 35.09 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 127.014 2.125 . . . . 0.0 115.547 173.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.71 164.13 20.58 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 126.035 1.734 . . . . 0.0 112.342 174.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 ttmt -75.79 42.12 0.23 Allowed 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 126.54 1.936 . . . . 0.0 114.194 -175.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -137.18 130.97 31.85 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.751 1.62 . . . . 0.0 110.969 176.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -154.31 -75.75 0.11 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.618 1.167 . . . . 0.0 111.685 171.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.2 mt -121.64 -8.76 9.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.025 0 C-N-CA 125.439 1.496 . . . . 0.0 113.394 -172.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.8 m-80 -70.6 -15.84 62.79 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -172.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 28.7 t -80.64 -49.02 11.79 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.935 0.894 . . . . 0.0 112.357 175.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -81.03 -17.68 49.4 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -174.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 4.5 p -80.86 -18.88 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.165 0.986 . . . . 0.0 112.864 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 5.5 t -110.19 64.88 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 125.478 1.511 . . . . 0.0 110.146 177.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.5 mt -120.13 110.24 16.4 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.288 1.435 . . . . 0.0 110.317 175.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -134.06 43.72 2.8 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 126.183 1.793 . . . . 0.0 111.623 -168.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.0 t30 50.58 59.77 15.81 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 126.953 2.101 . . . . 0.0 113.692 -175.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -81.2 58.73 7.09 Favored 'Trans proline' 0 CA--C 1.543 0.974 0 C-N-CA 124.329 3.353 . . . . 0.0 113.884 -167.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -138.7 13.59 2.72 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.8 t -119.66 104.1 45.32 Favored Pre-proline 0 N--CA 1.473 0.698 0 C-N-CA 125.653 1.581 . . . . 0.0 110.038 179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -77.83 111.46 3.11 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.27 2.647 . . . . 0.0 110.197 168.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 t -140.87 51.28 1.63 Allowed 'General case' 0 N--CA 1.478 0.935 0 CA-C-O 123.629 1.68 . . . . 0.0 111.932 -175.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -95.44 19.39 10.97 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.75 1.389 . . . . 0.0 114.75 -170.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.39 34.43 0.81 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 127.008 2.123 . . . . 0.0 112.103 -179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.7 t -151.04 65.38 0.91 Allowed 'General case' 0 N--CA 1.476 0.872 0 CA-C-O 124.024 1.869 . . . . 0.0 111.171 -173.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.52 -13.71 38.99 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 124.91 1.243 . . . . 0.0 115.223 179.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -79.69 -56.17 4.48 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 118.719 1.259 . . . . 0.0 112.405 174.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.4 109.13 4.38 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.3 1.44 . . . . 0.0 112.07 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 34.9 t -99.16 -72.0 0.67 Allowed 'General case' 0 CA--C 1.513 -0.466 0 C-N-CA 125.587 1.555 . . . . 0.0 111.652 -175.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -161.41 -46.56 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.949 0.499 . . . . 0.0 110.631 -174.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -56.11 -38.47 70.8 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.997 0.919 . . . . 0.0 110.469 172.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -67.37 -36.7 81.89 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.773 1.229 . . . . 0.0 111.8 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.0 mtmt -69.07 -37.5 78.51 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 121.387 -0.821 . . . . 0.0 112.144 170.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.8 mttm -65.17 -2.44 2.92 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 170.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.7 mt -103.45 -60.98 2.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 125.253 1.421 . . . . 0.0 110.411 161.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 26.0 t -74.52 -53.58 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 CA-C-N 119.776 1.171 . . . . 0.0 113.128 -168.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.98 -34.3 78.11 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.579 -0.7 . . . . 0.0 110.853 177.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.96 -34.04 75.38 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 113.308 0.855 . . . . 0.0 113.308 170.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.11 -40.02 75.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.082 -1.011 . . . . 0.0 111.954 174.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.52 -32.17 48.36 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.171 -0.956 . . . . 0.0 110.697 172.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.5 m -74.96 -11.64 60.16 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 171.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -105.08 -39.45 6.22 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 120.291 1.405 . . . . 0.0 112.899 -172.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.6 p -129.35 -15.88 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -170.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.81 -85.43 0.23 Allowed Glycine 0 N--CA 1.469 0.855 0 C-N-CA 124.726 1.155 . . . . 0.0 111.919 171.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.3 tt -165.88 -41.97 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 125.727 1.611 . . . . 0.0 111.142 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -110.32 -6.68 14.94 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.883 1.673 . . . . 0.0 115.305 -169.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.2 m-80 -95.89 -14.17 23.36 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 119.31 0.959 . . . . 0.0 113.091 -173.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.1 pp -65.88 159.69 24.95 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.349 1.459 . . . . 0.0 114.688 -178.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.7 t-20 -101.0 122.86 44.28 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.961 1.304 . . . . 0.0 111.474 -177.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -68.98 -21.13 64.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.866 1.266 . . . . 0.0 113.479 179.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 93.5 m -66.24 -41.33 90.18 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 121.399 -0.813 . . . . 0.0 111.491 174.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.91 -43.07 99.61 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.05 -1.031 . . . . 0.0 111.721 175.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -57.92 -44.56 86.91 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 121.765 -0.584 . . . . 0.0 112.286 170.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 10.4 p -61.86 -27.14 68.57 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 121.254 -0.904 . . . . 0.0 113.3 178.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -84.16 -38.5 20.58 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.807 1.643 . . . . 0.0 111.91 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.2 mmt-85 -91.17 -34.67 14.93 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 125.041 1.336 . . . . 0.0 114.276 -175.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 6.1 mp -92.96 -12.69 30.15 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.364 1.065 . . . . 0.0 112.937 174.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 58.73 65.33 1.25 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.056 1.343 . . . . 0.0 112.045 -179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -133.19 163.06 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 126.601 1.96 . . . . 0.0 111.586 -177.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 47.5 m -57.43 134.31 55.95 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 124.912 1.285 . . . . 0.0 109.65 163.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.8 t -59.1 -34.58 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 121.569 -0.707 . . . . 0.0 111.389 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -71.06 -29.01 64.78 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.249 -0.907 . . . . 0.0 113.363 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -68.71 -36.36 78.34 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.896 169.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.83 -50.13 65.72 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 119.08 0.855 . . . . 0.0 110.811 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -54.78 -38.83 67.73 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.195 1.398 . . . . 0.0 112.815 -179.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.4 t -88.15 -34.98 17.67 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 177.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -60.64 -38.01 83.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.085 -1.009 . . . . 0.0 112.266 177.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.8 mt -48.01 -60.07 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 124.813 1.245 . . . . 0.0 110.954 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -75.04 -21.9 58.76 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -82.06 -31.68 30.73 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 119.023 0.829 . . . . 0.0 112.83 176.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 20.4 t -85.36 -43.58 13.55 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.765 1.226 . . . . 0.0 112.595 178.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -133.88 84.24 2.11 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.065 1.346 . . . . 0.0 111.319 178.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 14.2 tpt180 -76.89 -41.12 45.0 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.605 0.762 . . . . 0.0 112.936 174.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 66.1 mtt -122.0 -29.59 4.23 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.757 1.623 . . . . 0.0 112.695 178.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.29 107.63 2.81 Favored Glycine 0 CA--C 1.529 0.963 0 C-N-CA 125.626 1.584 . . . . 0.0 111.513 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? 44.52 39.2 3.08 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.109 1.764 . . . . 0.0 112.827 -177.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 47.11 30.75 1.42 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 127.298 2.239 . . . . 0.0 114.021 -178.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.5 t-20 53.91 21.51 2.85 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 125.698 1.599 . . . . 0.0 114.926 -172.052 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . 0.262 0.0 OUTLIER -101.9 27.6 6.39 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 120.042 -1.661 . . . . 0.0 113.07 -172.167 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -114.63 9.95 16.64 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.51 1.524 . . . . 0.0 113.809 -172.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 25.0 pttt -93.91 -20.85 19.64 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 126.399 1.879 . . . . 0.0 115.041 -158.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 3.0 m -154.57 -51.48 0.09 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.335 1.854 . . . . 0.0 110.494 -169.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.7 pt -72.02 -174.66 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 C-N-CA 125.764 1.626 . . . . 0.0 111.382 171.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.3 mmpt? 65.03 -27.2 0.1 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 127.499 2.32 . . . . 0.0 116.386 -172.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -87.74 -18.57 29.15 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 119.943 1.247 . . . . 0.0 114.021 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.0 p90 -116.68 3.62 13.06 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 124.788 1.235 . . . . 0.0 114.135 178.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -100.86 147.07 26.52 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.078 1.351 . . . . 0.0 112.782 -173.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -138.16 42.78 2.22 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.587 1.555 . . . . 0.0 112.079 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -138.54 149.8 45.7 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.004 1.322 . . . . 0.0 112.913 176.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 55.6 t -136.08 -48.1 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 125.408 1.483 . . . . 0.0 111.168 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 63.2 p -118.41 24.39 10.96 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 126.504 1.922 . . . . 0.0 113.229 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . 0.283 86.7 p 52.58 21.84 1.97 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 127.788 2.435 . . . . 0.0 116.386 -176.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -130.98 111.82 12.39 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.673 1.589 . . . . 0.0 110.782 175.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 66.8 m -146.16 127.04 14.46 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.579 1.552 . . . . 0.0 109.679 -179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.0 29.99 11.04 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 -175.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -116.91 75.14 7.22 Favored Pre-proline 0 CA--C 1.548 0.872 0 C-N-CA 126.012 1.725 . . . . 0.0 112.377 -179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -67.01 114.63 3.25 Favored 'Trans proline' 0 CA--C 1.539 0.767 0 C-N-CA 123.171 2.581 . . . . 0.0 110.379 174.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -137.19 22.24 3.0 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -172.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.4 tp -135.42 84.9 33.48 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.47 1.508 . . . . 0.0 110.923 -174.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 C--O 1.254 1.317 0 C-N-CA 123.926 3.084 . . . . 0.0 113.237 179.685 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.587 0 N-CA-C 111.219 -0.753 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 31.1 m 58.49 178.56 0.07 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.967 1.707 . . . . 0.0 114.12 -172.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -140.64 133.91 29.67 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.025 0.93 . . . . 0.0 111.829 -178.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 98.3 mmm -133.74 43.65 2.84 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.444 1.497 . . . . 0.0 112.324 -169.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -145.34 95.99 2.76 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.944 1.298 . . . . 0.0 111.276 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.3 m -118.06 7.89 12.33 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.468 1.507 . . . . 0.0 114.493 -175.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? -151.69 -9.12 0.21 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.395 1.628 . . . . 0.0 115.395 -178.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -105.18 2.53 29.29 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.712 1.605 . . . . 0.0 112.369 174.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.48 15.94 2.01 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.046 1.739 . . . . 0.0 112.217 -166.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.9 mp -107.64 132.05 53.73 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.752 1.221 . . . . 0.0 110.361 175.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -149.22 -35.66 0.18 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 124.906 1.282 . . . . 0.0 112.645 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -83.39 42.91 0.85 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 125.819 1.647 . . . . 0.0 113.068 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 41.5 mm -105.75 134.51 47.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.589 1.555 . . . . 0.0 110.816 -173.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 73.9 mt -89.65 135.19 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 125.075 1.35 . . . . 0.0 109.726 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -134.61 164.23 27.96 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 125.276 1.43 . . . . 0.0 112.499 -177.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -138.68 166.24 24.88 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.789 1.636 . . . . 0.0 111.339 -175.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.328 14.9 tt 47.94 43.23 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.11 0 C-N-CA 126.931 2.092 . . . . 0.0 114.042 173.397 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.98 63.19 3.73 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.377 1.471 . . . . 0.0 113.096 -168.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt 52.41 44.86 29.47 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.714 1.606 . . . . 0.0 112.562 -176.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -74.05 111.39 9.16 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.843 1.257 . . . . 0.0 111.488 -174.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -123.38 -81.73 0.64 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.651 1.181 . . . . 0.0 112.708 175.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.4 mt -115.15 -11.47 12.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -167.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -71.63 -18.91 62.18 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -173.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -81.76 -42.77 19.29 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.395 1.078 . . . . 0.0 112.795 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.3 p30 -83.92 -17.91 39.14 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -175.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 77.3 t -81.2 -32.85 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 124.521 1.128 . . . . 0.0 111.667 177.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.7 t -113.02 77.41 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.025 1.33 . . . . 0.0 109.851 -176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.6 tt -126.72 131.31 51.38 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.638 1.575 . . . . 0.0 110.399 -177.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.5 mmmm -130.09 45.44 2.81 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.406 1.883 . . . . 0.0 112.483 -171.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -126.63 56.04 16.03 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 124.84 1.256 . . . . 0.0 113.604 177.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -72.2 91.01 0.75 Allowed 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.962 2.441 . . . . 0.0 110.796 175.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.4 mmt-85 -134.29 -69.43 0.53 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 125.619 1.568 . . . . 0.0 112.412 178.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 93.9 t -149.24 115.53 3.66 Favored Pre-proline 0 N--CA 1.475 0.781 0 C-N-CA 125.094 1.357 . . . . 0.0 109.711 -173.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.35 157.26 25.78 Favored 'Trans proline' 0 N--CA 1.459 -0.514 0 C-N-CA 122.976 2.45 . . . . 0.0 112.251 165.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.7 p -85.35 18.38 2.7 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 126.638 1.975 . . . . 0.0 115.462 178.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -113.71 81.82 1.58 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.254 1.022 . . . . 0.0 111.734 -169.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -129.53 35.2 4.24 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.931 1.692 . . . . 0.0 113.134 -178.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.9 t -138.46 10.8 2.74 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.964 1.305 . . . . 0.0 114.194 -166.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -72.41 -64.58 2.58 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 120.733 -1.23 . . . . 0.0 113.922 -173.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.2 mm-40 -127.2 1.77 6.43 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.857 1.263 . . . . 0.0 113.866 -171.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp -133.69 134.37 43.01 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.58 1.552 . . . . 0.0 111.207 -175.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 46.3 p -106.52 -83.05 0.53 Allowed 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 127.76 2.424 . . . . 0.0 111.688 -178.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -155.48 -48.97 0.08 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 124.664 1.186 . . . . 0.0 110.774 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.36 -28.55 69.36 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.497 0.719 . . . . 0.0 110.958 172.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -68.69 -37.1 79.3 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.231 1.012 . . . . 0.0 111.775 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -69.24 -34.06 74.24 Favored 'General case' 0 N--CA 1.481 1.112 0 O-C-N 120.788 -1.195 . . . . 0.0 112.971 169.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -63.56 -3.67 2.33 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.124 1.157 . . . . 0.0 114.124 169.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.6 mt -109.01 -49.67 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 125.674 1.59 . . . . 0.0 110.687 168.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 75.1 t -72.96 -65.1 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 CA-C-N 119.71 1.141 . . . . 0.0 112.321 -177.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.86 -32.28 73.71 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.668 0.787 . . . . 0.0 111.439 -173.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -59.7 -43.17 94.18 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 170.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -72.0 -35.78 69.56 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 121.229 -0.92 . . . . 0.0 112.086 179.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.63 -29.16 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 124.916 1.286 . . . . 0.0 111.536 170.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.0 t -77.06 -17.46 58.75 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 173.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -95.55 -50.14 5.09 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 120.704 -1.247 . . . . 0.0 111.996 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.5 m -124.03 -7.1 7.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -168.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 116.19 -76.08 0.27 Allowed Glycine 0 N--CA 1.467 0.765 0 C-N-CA 125.476 1.512 . . . . 0.0 112.83 163.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 55.0 tp -175.05 -33.85 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 127.031 2.133 . . . . 0.0 111.186 179.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.8 p30 -111.72 -6.1 14.37 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.175 1.39 . . . . 0.0 114.536 -165.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 67.8 m-80 -97.32 -21.33 17.29 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.159 0.984 . . . . 0.0 113.236 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.2 pp -68.09 167.05 14.78 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.53 0.732 . . . . 0.0 112.383 167.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -128.07 170.11 13.3 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 122.501 1.144 . . . . 0.0 112.28 174.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.94 -32.54 61.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.061 1.344 . . . . 0.0 112.947 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.42 -52.29 64.13 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.006 1.322 . . . . 0.0 111.149 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.29 -34.28 77.77 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 124.066 0.946 . . . . 0.0 112.341 179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 tp -66.92 -47.98 70.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.008 0.523 . . . . 0.0 111.361 173.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 28.1 p -60.18 -25.36 65.51 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.853 1.261 . . . . 0.0 113.98 179.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -82.13 -16.73 48.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.006 1.723 . . . . 0.0 113.434 -177.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -119.85 -42.46 2.61 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.77 1.628 . . . . 0.0 112.137 -175.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.7 tp -76.39 -12.42 60.05 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 126.371 1.868 . . . . 0.0 112.454 172.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.31 64.56 1.34 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.344 1.858 . . . . 0.0 112.592 170.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 20.8 pt -139.11 174.74 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 127.588 2.355 . . . . 0.0 109.966 -176.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.8 t -75.8 151.59 37.49 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 121.532 -0.73 . . . . 0.0 110.769 163.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.9 t -60.57 -34.28 57.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.025 0.93 . . . . 0.0 111.293 -178.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -67.19 -31.92 72.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.744 1.016 . . . . 0.0 113.744 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -69.23 -35.69 76.42 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 118.491 -0.766 . . . . 0.0 111.19 170.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.31 -45.13 73.81 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.02 0.827 . . . . 0.0 110.946 177.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.78 -39.12 73.5 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.079 1.351 . . . . 0.0 112.813 178.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -87.3 -40.38 14.54 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 177.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -54.21 -41.65 68.88 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.063 -1.023 . . . . 0.0 112.241 177.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.3 mt -54.68 -36.94 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 124.311 1.044 . . . . 0.0 112.695 178.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -92.93 -34.6 13.72 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 119.948 1.249 . . . . 0.0 113.001 175.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -73.22 -31.94 64.45 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 123.162 0.585 . . . . 0.0 112.536 -170.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 72.6 m -89.2 -33.41 17.03 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.195 1.398 . . . . 0.0 113.701 178.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -152.52 83.48 1.24 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.007 1.323 . . . . 0.0 111.16 -178.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 -75.94 -18.66 59.26 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.971 1.308 . . . . 0.0 113.718 176.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 75.5 mtm -82.62 46.93 1.12 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.024 1.73 . . . . 0.0 114.748 -156.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -178.01 17.62 0.03 OUTLIER Glycine 0 CA--C 1.539 1.565 0 C-N-CA 125.544 1.545 . . . . 0.0 114.803 177.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 73.1 mtp85 -87.53 -53.95 4.53 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 125.033 1.333 . . . . 0.0 113.378 -174.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 13.8 t -141.8 9.37 1.96 Allowed 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 126.522 1.929 . . . . 0.0 112.865 -177.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.0 m120 53.46 20.1 1.91 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.08 2.152 . . . . 0.0 115.894 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -87.72 -4.85 58.89 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.086 1.354 . . . . 0.0 113.85 -175.286 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.6 p90 -75.93 8.79 2.83 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.484 1.914 . . . . 0.0 115.004 -166.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -85.73 -7.11 58.98 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.918 1.687 . . . . 0.0 114.704 -170.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 53.5 m -139.39 -43.89 0.45 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 126.216 1.807 . . . . 0.0 110.315 -165.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 40.1 pt -64.94 172.23 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 C-N-CA 123.832 0.853 . . . . 0.0 111.92 170.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? 66.07 -18.28 0.11 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 127.387 2.275 . . . . 0.0 116.734 178.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.47 -15.55 8.02 Favored 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 120.402 1.456 . . . . 0.0 114.531 179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -104.28 -25.36 12.91 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -165.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.1 pp20? -80.41 129.67 34.66 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.7 0.8 . . . . 0.0 112.477 -176.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -159.92 131.57 6.1 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.158 1.383 . . . . 0.0 111.615 179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -148.02 142.08 25.97 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.12 1.768 . . . . 0.0 110.288 172.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.5 t -134.55 -50.65 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 124.15 0.98 . . . . 0.0 111.989 178.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 24.2 m -111.9 3.74 17.77 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.399 1.079 . . . . 0.0 113.829 -173.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.3 m -116.28 -3.6 11.95 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 115.163 1.542 . . . . 0.0 115.163 -164.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.43 131.97 34.15 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.212 1.005 . . . . 0.0 112.556 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.2 t -153.79 170.0 22.0 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.943 1.697 . . . . 0.0 109.902 171.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -62.63 -31.77 72.68 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.041 0.756 . . . . 0.0 113.041 174.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -156.22 154.03 26.52 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 126.986 2.114 . . . . 0.0 112.838 173.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -81.94 69.53 7.54 Favored 'Trans proline' 0 CA--C 1.545 1.069 0 C-N-CA 124.325 3.35 . . . . 0.0 112.213 -175.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -126.91 87.44 2.65 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.237 1.415 . . . . 0.0 111.16 -175.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 74.3 mt -66.75 -52.51 33.17 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.61 1.164 . . . . 0.0 114.117 169.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo . . . . . 0 C--O 1.252 1.221 0 C-N-CA 124.113 3.209 . . . . 0.0 112.896 174.353 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 112.109 -0.396 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 21.0 m 52.76 41.38 31.58 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 125.738 1.615 . . . . 0.0 114.746 174.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 13.2 t60 -74.16 112.83 10.69 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 123.85 0.86 . . . . 0.0 112.199 -172.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 86.5 mtp -134.42 89.59 2.57 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.987 1.715 . . . . 0.0 109.38 174.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -158.49 117.26 3.05 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 126.391 1.876 . . . . 0.0 108.074 175.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 34.2 t -137.52 -49.2 0.59 Allowed 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.129 1.372 . . . . 0.0 112.451 169.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.2 mtt -74.91 -13.63 60.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 114.832 1.419 . . . . 0.0 114.832 -170.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -113.96 12.36 18.03 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 127.011 2.125 . . . . 0.0 111.643 174.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.42 42.04 0.9 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.749 1.62 . . . . 0.0 111.71 -162.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 tp -135.6 2.99 2.99 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -176.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -87.04 -32.63 19.89 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.782 1.401 . . . . 0.0 114.782 -164.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -131.64 15.17 4.91 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.35 1.46 . . . . 0.0 113.731 -175.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 25.9 mm -73.21 131.47 34.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 125.053 1.341 . . . . 0.0 111.684 -171.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.3 tp -150.27 126.87 2.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 C-N-CA 125.233 1.413 . . . . 0.0 110.744 171.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -162.4 159.25 25.01 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.618 1.567 . . . . 0.0 112.045 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.1 pm0 -90.58 178.31 6.12 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.645 1.178 . . . . 0.0 113.058 168.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.5 tp -113.13 13.89 8.35 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.973 0 C-N-CA 126.971 2.108 . . . . 0.0 113.64 -173.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -140.54 160.1 40.75 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.774 1.63 . . . . 0.0 112.257 -170.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -82.2 8.56 10.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.029 1.332 . . . . 0.0 113.946 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -100.84 141.03 34.3 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.948 1.699 . . . . 0.0 110.755 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -147.32 -82.07 0.13 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.66 1.584 . . . . 0.0 112.16 174.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 95.2 mt -123.96 4.26 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.968 1.707 . . . . 0.0 111.96 -171.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.6 m-20 -91.59 0.52 57.49 Favored 'General case' 0 CA--C 1.545 0.78 0 O-C-N 120.642 -1.286 . . . . 0.0 113.87 -173.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.0 p -122.76 -49.89 1.98 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.273 1.429 . . . . 0.0 112.931 -174.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.7 p-10 -65.53 -27.35 68.39 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.369 1.468 . . . . 0.0 114.542 177.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 88.5 t -89.07 -26.04 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 125.141 1.376 . . . . 0.0 111.895 175.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.6 t -125.95 75.2 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 125.447 1.499 . . . . 0.0 110.229 -173.102 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -124.92 143.2 50.99 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.639 1.576 . . . . 0.0 111.651 -177.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -113.21 16.44 19.12 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 125.714 1.606 . . . . 0.0 114.312 -176.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -135.11 60.17 38.22 Favored Pre-proline 0 CA--C 1.553 1.059 0 C-N-CA 124.786 1.235 . . . . 0.0 112.988 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -81.92 56.35 5.83 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.556 2.837 . . . . 0.0 112.48 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -133.81 -82.38 0.46 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.428 1.491 . . . . 0.0 112.558 -169.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 39.9 t -141.07 100.12 6.49 Favored Pre-proline 0 N--CA 1.48 1.073 0 C-N-CA 124.778 1.231 . . . . 0.0 110.452 -174.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -79.9 157.98 24.17 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.93 2.42 . . . . 0.0 113.248 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.6 p -79.27 59.8 2.92 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 128.255 2.622 . . . . 0.0 113.682 -173.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -86.77 16.19 5.04 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -170.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.03 63.07 7.14 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 126.257 1.823 . . . . 0.0 111.822 -163.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.8 t -142.23 10.89 1.93 Allowed 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 114.56 1.319 . . . . 0.0 114.56 -171.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -68.26 -45.37 70.65 Favored Glycine 0 CA--C 1.538 1.474 0 O-C-N 120.705 -1.247 . . . . 0.0 115.204 -171.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -131.91 -55.36 0.99 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.965 1.306 . . . . 0.0 112.159 -178.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.3 mp -110.66 114.16 27.32 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 127.258 2.223 . . . . 0.0 108.398 177.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 96.6 p -98.01 -71.16 0.7 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.375 1.07 . . . . 0.0 111.869 172.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -159.69 -29.05 0.06 Allowed 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -170.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -85.86 -28.92 24.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.165 0.586 . . . . 0.0 110.684 173.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.8 mp0 -78.03 -39.32 42.38 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.242 -0.911 . . . . 0.0 111.257 -167.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -68.34 -29.92 68.76 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.746 0.818 . . . . 0.0 112.566 171.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -65.11 -7.62 13.11 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.5 mt -103.29 -56.47 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 124.956 1.302 . . . . 0.0 109.763 167.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.4 t -66.6 -55.84 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 119.753 1.16 . . . . 0.0 112.198 -173.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.1 -35.92 78.93 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.739 -0.601 . . . . 0.0 111.253 -176.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -60.03 -42.72 95.0 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 170.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.21 -36.13 76.94 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.309 1.044 . . . . 0.0 112.047 178.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -58.81 -35.62 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 O-C-N 120.859 -1.151 . . . . 0.0 111.399 174.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.6 m -70.45 -12.3 61.49 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 114.36 1.244 . . . . 0.0 114.36 173.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -91.69 -43.73 9.42 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 120.14 1.337 . . . . 0.0 112.178 178.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.1 -10.71 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 115.619 1.711 . . . . 0.0 115.619 -165.56 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 125.02 -79.36 0.36 Allowed Glycine 0 N--CA 1.468 0.825 0 C-N-CA 124.714 1.149 . . . . 0.0 111.696 170.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 6.5 tt -171.23 -43.84 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.559 1.944 . . . . 0.0 111.438 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -106.73 -12.04 15.64 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.996 1.719 . . . . 0.0 114.667 -167.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -90.12 -21.7 22.13 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -175.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.6 pp -63.07 164.59 8.2 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.664 1.186 . . . . 0.0 113.224 168.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.97 164.9 12.87 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 122.383 1.087 . . . . 0.0 112.139 172.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.88 -29.38 44.39 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.707 1.203 . . . . 0.0 113.269 -178.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.5 m -59.81 -43.58 94.42 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.371 1.468 . . . . 0.0 111.767 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -67.92 -25.81 65.66 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.637 -1.29 . . . . 0.0 113.545 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.75 -50.32 17.79 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 118.978 0.808 . . . . 0.0 111.445 170.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 77.3 p -59.94 -26.06 65.67 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 -179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -76.24 -26.79 56.37 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 125.496 1.518 . . . . 0.0 114.074 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 78.8 mtt85 -113.87 -39.35 4.0 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 125.078 1.351 . . . . 0.0 113.112 -172.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.6 tt -84.08 -19.35 34.45 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.404 1.881 . . . . 0.0 111.112 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 60.32 72.71 0.51 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.706 2.002 . . . . 0.0 112.473 -178.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.8 pt -135.28 164.4 33.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 C-N-CA 127.367 2.267 . . . . 0.0 110.356 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.5 m -62.9 140.35 58.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.739 1.216 . . . . 0.0 109.913 166.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.9 t -57.54 -38.65 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 O-C-N 121.483 -0.76 . . . . 0.0 111.436 -178.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -74.06 -26.79 60.59 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.447 -0.783 . . . . 0.0 113.102 178.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.39 -37.54 80.47 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 118.104 -0.95 . . . . 0.0 110.597 167.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.0 -47.51 74.24 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 119.286 0.948 . . . . 0.0 111.54 176.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -57.74 -43.77 85.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.931 1.292 . . . . 0.0 112.498 177.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -84.62 -34.34 23.13 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 23.2 t80 -55.37 -48.36 74.4 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.376 1.07 . . . . 0.0 111.266 175.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 42.7 mt -46.13 -59.26 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 124.752 1.221 . . . . 0.0 110.472 179.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -87.5 -3.22 59.0 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 115.753 1.76 . . . . 0.0 115.753 -172.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -98.79 -34.58 10.44 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 119.256 0.935 . . . . 0.0 112.66 170.596 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 69.8 m -92.45 -27.94 17.15 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.678 1.191 . . . . 0.0 113.348 -178.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -148.03 70.49 1.15 Allowed 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.116 1.366 . . . . 0.0 111.668 178.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 34.0 ttp85 -66.71 -39.73 88.17 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -173.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 61.1 mtt -131.17 -22.5 2.53 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.521 1.128 . . . . 0.0 113.778 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.86 -117.74 0.49 Allowed Glycine 0 N--CA 1.47 0.934 0 CA-C-N 118.758 0.708 . . . . 0.0 111.719 178.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 95.1 mtt-85 -70.92 -93.37 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 123.37 0.668 . . . . 0.0 109.477 161.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -147.31 47.99 1.12 Allowed 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 178.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 22.4 m120 55.44 24.0 6.33 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 116.644 2.09 . . . . 0.0 116.644 168.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -108.77 -0.51 19.92 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.384 1.474 . . . . 0.0 114.038 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 11.2 p90 -76.28 19.68 0.24 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.847 1.659 . . . . 0.0 114.671 -175.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 47.6 mtmt -93.51 -2.11 54.78 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 127.103 2.161 . . . . 0.0 114.262 -162.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.1 m -148.33 -46.04 0.15 Allowed 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 127.936 2.494 . . . . 0.0 108.763 -170.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.3 pt -73.07 161.2 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 C-N-CA 124.203 1.001 . . . . 0.0 111.424 169.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.6 mptt 61.38 18.79 9.62 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.526 1.53 . . . . 0.0 114.812 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 38.8 mtt -124.67 -44.96 1.94 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.833 1.253 . . . . 0.0 113.172 174.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -115.77 27.33 9.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.664 1.586 . . . . 0.0 112.074 -175.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -137.37 160.94 37.66 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.199 1.8 . . . . 0.0 112.075 -167.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -88.97 152.57 21.63 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.653 1.181 . . . . 0.0 112.631 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -146.53 149.92 34.55 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.222 1.409 . . . . 0.0 112.368 178.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.9 t -139.99 -51.99 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 125.276 1.43 . . . . 0.0 111.131 177.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.2 m -121.4 20.04 11.26 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.258 1.423 . . . . 0.0 112.958 -176.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t -139.16 33.73 2.12 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.644 1.578 . . . . 0.0 112.966 -173.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -147.84 163.83 35.55 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.532 1.533 . . . . 0.0 112.204 -179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 66.6 m -143.41 140.12 30.28 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 125.776 1.63 . . . . 0.0 110.429 -176.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 51.26 34.92 12.39 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 124.779 1.232 . . . . 0.0 113.807 -173.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -120.04 95.63 49.16 Favored Pre-proline 0 CA--C 1.546 0.819 0 C-N-CA 126.413 1.885 . . . . 0.0 111.218 -175.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -81.01 55.21 5.59 Favored 'Trans proline' 0 CA--C 1.545 1.05 0 C-N-CA 124.538 3.492 . . . . 0.0 111.89 -179.312 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -82.91 60.59 5.49 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.567 1.547 . . . . 0.0 112.113 -171.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -118.61 93.2 45.49 Favored Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 126.193 1.797 . . . . 0.0 110.492 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 C--O 1.254 1.276 0 C-N-CA 123.821 3.014 . . . . 0.0 113.349 -179.897 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 28.3 p -146.84 157.86 43.77 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 125.475 1.51 . . . . 0.0 112.37 178.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 67.8 t60 -148.18 144.09 27.49 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.858 1.263 . . . . 0.0 111.03 170.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 66.2 mtt -128.92 97.14 4.55 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.104 1.362 . . . . 0.0 110.72 179.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -152.78 101.8 2.64 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.925 1.69 . . . . 0.0 109.716 175.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 2.7 t -111.49 0.82 16.64 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.244 1.418 . . . . 0.0 114.003 -175.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.9 mtt -136.58 -5.0 2.01 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -170.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -128.19 10.72 6.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.893 1.677 . . . . 0.0 112.016 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.16 27.27 0.69 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.232 1.413 . . . . 0.0 112.304 -162.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.2 17.08 3.44 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 115.062 1.504 . . . . 0.0 115.062 -167.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -135.97 -18.15 1.6 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.224 1.565 . . . . 0.0 115.224 -167.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -88.96 29.43 1.04 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.228 1.811 . . . . 0.0 114.278 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.8 mp -76.92 97.51 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 124.475 1.11 . . . . 0.0 110.321 -178.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 62.5 mt -139.08 139.79 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 126.022 1.729 . . . . 0.0 109.641 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -105.73 112.08 25.01 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.976 1.31 . . . . 0.0 110.16 171.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -158.04 170.2 22.83 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.277 1.431 . . . . 0.0 111.277 -179.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 43.4 pt -118.93 116.95 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 C-N-CA 125.967 1.707 . . . . 0.0 110.668 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -143.49 173.48 11.59 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.529 2.332 . . . . 0.0 110.698 -167.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -74.9 67.5 1.67 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.218 1.007 . . . . 0.0 111.18 166.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -67.41 107.05 2.3 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.892 1.277 . . . . 0.0 110.753 175.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -112.07 -78.02 0.58 Allowed 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 124.649 1.18 . . . . 0.0 112.213 174.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 52.9 mt -116.17 -8.54 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -170.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -78.49 -14.82 59.18 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.534 0.938 . . . . 0.0 113.534 -177.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.0 t -92.41 -39.65 11.31 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.134 0.974 . . . . 0.0 113.224 -168.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -71.28 -14.81 62.34 Favored 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.7 t -74.17 -27.37 21.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.458 1.503 . . . . 0.0 111.805 177.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.2 t -129.04 80.45 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 C-N-CA 125.371 1.468 . . . . 0.0 109.143 178.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.6 tp -130.97 143.34 50.65 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.272 1.429 . . . . 0.0 111.502 -175.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -115.79 27.07 9.54 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 126.171 1.788 . . . . 0.0 113.332 -178.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -129.39 56.02 21.72 Favored Pre-proline 0 CA--C 1.555 1.154 0 C-N-CA 125.299 1.44 . . . . 0.0 113.149 179.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -78.34 56.55 5.87 Favored 'Trans proline' 0 CA--C 1.546 1.121 0 C-N-CA 124.137 3.225 . . . . 0.0 113.884 -172.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 80.7 mtt180 -79.71 -54.07 6.21 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.031 1.333 . . . . 0.0 112.183 174.596 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 59.8 t 45.75 106.97 0.01 OUTLIER Pre-proline 0 N--CA 1.477 0.912 0 C-N-CA 129.098 2.959 . . . . 0.0 114.378 -171.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -71.5 165.74 31.54 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.604 2.203 . . . . 0.0 113.263 -178.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 20.7 p -78.05 43.53 0.44 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 127.483 2.313 . . . . 0.0 114.94 -168.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.5 pt20 -134.21 21.42 3.74 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 115.462 1.653 . . . . 0.0 115.462 -175.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.442 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 5.8 mmpt? -75.78 66.95 2.14 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.184 1.794 . . . . 0.0 111.922 173.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 t -115.64 8.39 15.01 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.036 1.734 . . . . 0.0 113.434 179.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 84.6 -0.18 89.24 Favored Glycine 0 CA--C 1.538 1.504 0 C-N-CA 125.328 1.442 . . . . 0.0 116.331 173.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -92.71 -48.11 6.75 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 119.623 1.712 . . . . 0.0 113.671 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 mp -146.94 121.99 10.09 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.16 1.384 . . . . 0.0 111.752 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.4 m -102.71 -72.36 0.69 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.493 1.517 . . . . 0.0 112.227 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -162.47 -44.39 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.176 0.59 . . . . 0.0 111.498 -173.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -61.26 -33.78 74.09 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.588 0.755 . . . . 0.0 110.916 170.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.4 mp0 -68.77 -37.58 79.45 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 124.626 1.171 . . . . 0.0 111.645 -177.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt -66.32 -35.21 79.79 Favored 'General case' 0 N--CA 1.476 0.853 0 O-C-N 121.146 -0.972 . . . . 0.0 112.831 171.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -65.06 -1.33 2.04 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 171.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 16.6 mt -113.58 -14.39 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 126.354 1.862 . . . . 0.0 112.098 174.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 21.3 t -124.73 -58.96 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.124 0.97 . . . . 0.0 112.642 -174.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.15 -37.75 86.38 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 119.423 1.011 . . . . 0.0 111.089 175.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -64.21 -32.03 73.46 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.713 0.805 . . . . 0.0 113.049 171.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -77.51 -38.4 48.97 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.027 0.931 . . . . 0.0 111.871 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.3 mp -60.14 -33.05 52.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.7 1.2 . . . . 0.0 110.462 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.9 t -71.14 -16.38 62.55 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 171.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -104.79 -42.91 5.24 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 120.681 -1.262 . . . . 0.0 113.024 -171.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.2 m -127.61 -13.21 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.19 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -172.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -82.52 0.31 Allowed Glycine 0 N--CA 1.468 0.811 0 C-N-CA 125.056 1.313 . . . . 0.0 112.195 168.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.7 tt -171.75 -43.86 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 111.342 -178.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -112.26 -4.08 14.44 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.003 1.721 . . . . 0.0 114.932 -168.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -93.37 -22.3 19.02 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.567 1.147 . . . . 0.0 112.792 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.9 pp -66.77 165.72 14.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.946 1.298 . . . . 0.0 112.313 164.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 15.0 p30 -118.24 172.53 7.38 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.394 1.093 . . . . 0.0 111.599 171.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.81 -33.0 58.0 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.686 1.194 . . . . 0.0 112.815 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.9 m -65.42 -48.06 74.11 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 125.729 1.611 . . . . 0.0 112.194 -173.739 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -66.47 -29.57 69.72 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 120.734 -1.229 . . . . 0.0 112.686 178.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.8 tt -76.29 -46.97 25.43 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.326 1.45 . . . . 0.0 110.293 177.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 82.6 p -67.89 -29.3 68.37 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 125.02 1.328 . . . . 0.0 113.469 177.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -66.81 -39.4 87.72 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.866 1.266 . . . . 0.0 112.675 174.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 83.4 mtt85 -86.99 -42.08 13.4 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.384 1.074 . . . . 0.0 113.28 -179.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.9 tt -81.26 -18.35 46.27 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.129 1.372 . . . . 0.0 111.829 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 62.67 68.3 0.66 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 126.604 1.961 . . . . 0.0 112.08 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.1 pt -135.41 177.63 6.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 127.231 2.213 . . . . 0.0 110.833 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.7 m -73.15 144.4 46.92 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.703 1.601 . . . . 0.0 109.813 166.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.7 t -58.79 -39.89 78.3 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 O-C-N 121.442 -0.786 . . . . 0.0 111.434 -179.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -69.63 -30.29 67.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.0 mmtt -64.5 -38.42 90.97 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 118.261 -0.876 . . . . 0.0 111.161 170.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.61 -48.26 64.56 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.909 0.777 . . . . 0.0 110.216 175.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -56.34 -42.63 78.04 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.837 1.255 . . . . 0.0 112.891 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.2 t -82.21 -38.11 25.04 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 178.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -61.59 -36.8 81.72 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.861 -1.149 . . . . 0.0 112.937 177.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.3 mt -49.84 -45.77 21.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.154 0.981 . . . . 0.0 111.191 173.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.1 pttt -93.31 -13.0 28.71 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 115.259 1.578 . . . . 0.0 115.259 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -82.92 -32.02 27.45 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.843 1.201 . . . . 0.0 112.409 169.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -84.42 -47.34 10.77 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.396 1.078 . . . . 0.0 112.821 -179.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -102.82 -29.01 11.72 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -173.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 52.09 37.8 22.46 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 127.046 2.138 . . . . 0.0 114.471 175.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 15.9 mmt 62.74 -45.75 0.19 Allowed 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 128.021 2.528 . . . . 0.0 115.448 -173.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 112.65 -58.0 0.42 Allowed Glycine 0 N--CA 1.467 0.718 0 C-N-CA 127.099 2.285 . . . . 0.0 111.13 168.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -136.93 68.26 1.43 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.594 1.558 . . . . 0.0 111.316 173.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 57.3 p 55.71 32.15 18.82 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 126.135 1.774 . . . . 0.0 114.334 165.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -75.95 -5.28 45.47 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.62 1.568 . . . . 0.0 112.228 -171.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.94 -20.15 66.11 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 128.712 2.805 . . . . 0.0 113.592 173.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -66.66 12.56 0.07 Allowed 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 116.949 2.203 . . . . 0.0 116.949 -172.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -5.58 59.32 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 115.308 1.596 . . . . 0.0 115.308 -169.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.7 m -139.0 -47.44 0.48 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.445 1.498 . . . . 0.0 110.806 -167.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 31.5 pt -71.12 165.1 2.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 C-N-CA 124.192 0.997 . . . . 0.0 111.828 177.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? 65.24 -14.45 0.11 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 126.787 2.035 . . . . 0.0 116.417 176.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 49.4 mtm -85.21 -43.55 13.69 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 119.787 1.176 . . . . 0.0 112.783 -176.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -103.75 -7.6 20.48 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -176.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -83.1 100.21 10.37 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 124.59 1.156 . . . . 0.0 110.757 -173.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -152.93 163.97 38.8 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.32 1.448 . . . . 0.0 111.618 -175.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -72.12 143.81 48.86 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.466 1.107 . . . . 0.0 112.495 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.2 t -128.89 -51.15 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.689 1.195 . . . . 0.0 111.253 179.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 58.5 p -103.87 -4.31 23.67 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 125.067 1.347 . . . . 0.0 114.128 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 25.5 m -100.86 -3.15 30.34 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.902 1.445 . . . . 0.0 114.902 -171.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.9 148.82 31.12 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.344 1.058 . . . . 0.0 112.891 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 75.2 m -151.2 135.71 17.02 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.84 1.656 . . . . 0.0 109.775 -178.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 51.26 35.21 13.06 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 124.48 1.112 . . . . 0.0 113.924 -174.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 24.2 mm-40 -124.44 148.67 59.13 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 126.266 1.827 . . . . 0.0 111.903 177.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -68.83 115.71 4.09 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.353 2.702 . . . . 0.0 110.988 178.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -143.55 51.99 1.34 Allowed 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.763 1.225 . . . . 0.0 111.789 -173.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 95.9 mt -120.48 76.27 25.97 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 125.651 1.58 . . . . 0.0 111.037 -178.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 C--O 1.253 1.232 0 C-N-CA 124.043 3.162 . . . . 0.0 113.231 178.658 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.596 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 53.5 m -129.52 153.24 48.21 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.542 1.537 . . . . 0.0 111.872 -177.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -123.61 49.01 1.77 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.019 1.327 . . . . 0.0 111.987 -173.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 98.4 mmm -88.41 84.57 6.81 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.379 1.072 . . . . 0.0 110.775 179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.0 14.76 5.23 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 115.006 1.484 . . . . 0.0 115.006 -173.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 59.9 m -91.21 1.24 57.25 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -169.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 ptp -150.63 -4.61 0.32 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 115.131 1.53 . . . . 0.0 115.131 -175.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -114.87 -8.07 12.58 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.535 1.534 . . . . 0.0 112.87 179.262 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -140.77 21.83 2.31 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 126.039 1.736 . . . . 0.0 111.662 -165.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -112.18 110.95 21.51 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 125.253 1.421 . . . . 0.0 109.662 173.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -147.64 23.9 1.11 Allowed 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 125.208 1.403 . . . . 0.0 112.747 179.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 51.03 61.83 3.03 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.574 1.949 . . . . 0.0 114.338 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.4 mp -93.71 56.54 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 125.114 1.366 . . . . 0.0 110.839 -170.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 52.5 mt -117.98 108.53 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 125.118 1.367 . . . . 0.0 109.333 -176.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -152.84 -57.02 0.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.427 1.091 . . . . 0.0 111.945 177.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -153.01 147.66 26.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.335 1.454 . . . . 0.0 111.322 178.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 33.6 pt -138.82 140.06 39.6 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 127.146 2.178 . . . . 0.0 109.164 172.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.66 -72.86 0.24 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.847 1.259 . . . . 0.0 112.158 177.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -145.83 -34.88 0.3 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.667 1.987 . . . . 0.0 112.625 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -128.14 124.91 38.06 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.266 1.426 . . . . 0.0 111.56 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -146.33 -65.03 0.3 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.898 0.879 . . . . 0.0 112.37 168.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.5 tt -91.19 -21.11 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 N-CA-C 115.934 1.827 . . . . 0.0 115.934 -168.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 -69.8 -15.14 63.06 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.609 -0.723 . . . . 0.0 112.88 -171.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 t -64.47 -29.81 70.85 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.573 1.149 . . . . 0.0 112.393 173.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -83.32 -30.75 27.26 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.978 0.911 . . . . 0.0 112.443 174.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 64.0 t -76.35 -44.97 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 C-N-CA 124.831 1.252 . . . . 0.0 111.063 -173.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 15.4 t -99.72 71.51 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 125.053 1.341 . . . . 0.0 109.18 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 15.0 tp -142.65 155.25 44.9 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.849 1.26 . . . . 0.0 112.302 -172.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.6 mtpp -100.41 25.29 7.81 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 126.346 1.859 . . . . 0.0 113.621 -171.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 50.22 54.9 16.35 Favored Pre-proline 0 CA--C 1.559 1.314 0 C-N-CA 126.746 2.018 . . . . 0.0 114.769 -176.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.42 89.47 0.94 Allowed 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.632 2.888 . . . . 0.0 111.324 179.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? 51.92 65.13 1.59 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 126.211 1.805 . . . . 0.0 112.362 -178.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 29.9 t -116.35 95.68 45.92 Favored Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 125.404 1.482 . . . . 0.0 110.159 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -79.7 172.99 13.51 Favored 'Trans proline' 0 CA--C 1.538 0.725 0 C-N-CA 123.848 3.032 . . . . 0.0 112.879 172.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.7 p -130.04 72.3 1.48 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 125.429 1.492 . . . . 0.0 112.328 -161.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -108.15 19.2 20.24 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -171.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.58 41.27 0.62 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 126.852 2.061 . . . . 0.0 112.501 -176.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.6 t -129.45 9.48 5.57 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 125.191 1.396 . . . . 0.0 114.649 -164.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.65 12.35 41.41 Favored Glycine 0 CA--C 1.539 1.55 0 C-N-CA 125.338 1.447 . . . . 0.0 115.902 -175.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -123.18 48.32 1.84 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.516 1.526 . . . . 0.0 112.759 -168.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 62.56 70.94 0.54 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.981 2.112 . . . . 0.0 113.424 171.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.5 t -127.72 78.96 1.86 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.041 1.737 . . . . 0.0 111.585 -161.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 59.34 18.73 6.98 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 126.493 1.917 . . . . 0.0 116.105 166.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -144.58 -38.88 0.28 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.124 1.77 . . . . 0.0 110.916 176.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -67.03 -47.2 72.14 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 121.298 -0.876 . . . . 0.0 111.678 -178.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.7 ptpt -65.78 -25.77 67.41 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.86 -1.15 . . . . 0.0 113.125 171.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -69.01 -11.04 60.42 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 114.225 1.194 . . . . 0.0 114.225 169.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 6.0 mt -95.46 -51.49 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.114 1.365 . . . . 0.0 109.82 165.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.48 -60.05 2.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 123.569 0.748 . . . . 0.0 111.829 -169.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -70.0 -28.55 65.6 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.167 0.44 . . . . 0.0 111.659 -176.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -58.28 -43.44 87.98 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 165.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.72 -38.36 88.97 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 119.173 0.897 . . . . 0.0 111.836 174.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.1 mm -57.05 -35.02 46.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 O-C-N 120.473 -1.392 . . . . 0.0 111.076 175.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.8 m -75.61 -8.41 56.7 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 115.385 1.624 . . . . 0.0 115.385 173.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.51 -53.43 4.06 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 120.473 1.488 . . . . 0.0 111.956 178.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.1 m -120.77 -13.93 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 N-CA-C 115.037 1.495 . . . . 0.0 115.037 -165.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.41 -75.25 0.43 Allowed Glycine 0 N--CA 1.469 0.854 0 C-N-CA 124.57 1.081 . . . . 0.0 112.998 164.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 51.4 tp -164.94 -43.57 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.656 1.182 . . . . 0.0 112.215 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -112.4 -5.35 14.11 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.944 1.298 . . . . 0.0 114.393 -168.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.6 m-80 -92.93 -15.1 26.7 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.125 0.97 . . . . 0.0 113.212 -174.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.6 pp -68.25 166.42 16.41 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.687 1.195 . . . . 0.0 111.75 166.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.8 p30 -115.82 167.58 10.81 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 122.48 1.133 . . . . 0.0 111.789 170.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.38 -22.89 38.02 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.402 1.081 . . . . 0.0 112.577 -179.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 23.8 m -66.1 -49.57 67.09 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.777 1.631 . . . . 0.0 111.441 -178.167 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -64.06 -43.79 94.4 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 121.049 -1.032 . . . . 0.0 111.917 178.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.7 mp -55.98 -58.48 7.74 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 123.642 0.777 . . . . 0.0 111.386 171.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.7 p -61.36 -21.33 63.94 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -178.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -78.81 -43.15 25.93 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.897 1.279 . . . . 0.0 112.345 175.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 58.9 mmt-85 -79.7 -34.12 40.45 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.945 1.298 . . . . 0.0 113.234 177.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 81.8 mt -87.31 -23.8 24.52 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.955 1.702 . . . . 0.0 113.548 -179.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.17 49.16 9.54 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.083 1.353 . . . . 0.0 112.262 -174.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.9 pt -107.24 172.44 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 126.738 2.015 . . . . 0.0 110.712 169.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.5 m -71.38 137.93 48.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 125.283 1.433 . . . . 0.0 109.538 165.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 t -56.28 -38.83 56.7 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.778 0.831 . . . . 0.0 111.672 -178.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -72.92 -22.18 60.77 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -75.23 -37.07 61.22 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.696 166.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.9 -47.81 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 118.387 0.54 . . . . 0.0 110.813 177.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -51.46 -37.17 47.51 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.313 1.845 . . . . 0.0 113.567 179.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 6.5 t -96.26 -30.64 13.34 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 178.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -63.85 -32.37 73.86 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 121.003 -1.061 . . . . 0.0 112.499 174.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 33.2 mt -50.92 -27.11 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.54 1.536 . . . . 0.0 112.791 173.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -115.34 -26.02 7.76 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 176.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -80.89 35.14 0.36 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.906 1.282 . . . . 0.0 112.542 171.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.1 t -157.47 -48.82 0.07 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.137 1.375 . . . . 0.0 112.727 177.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -135.62 28.43 3.3 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -161.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 33.6 ptt-85 -75.21 -10.72 59.72 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 -177.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 9.4 ttp -142.31 60.03 1.45 Allowed 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.618 0.723 . . . . 0.0 112.809 -169.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -81.19 -106.82 0.33 Allowed Glycine 0 CA--C 1.534 1.223 0 C-N-CA 124.523 1.058 . . . . 0.0 111.697 174.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -100.61 52.23 0.87 Allowed 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 125.086 1.355 . . . . 0.0 112.354 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 17.5 p 52.76 19.46 1.28 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.531 1.678 . . . . 0.0 115.531 170.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 50.85 15.01 0.21 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 126.434 1.893 . . . . 0.0 115.193 -164.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.6 -14.21 58.97 Favored 'General case' 0 CA--C 1.548 0.893 0 O-C-N 120.018 -1.676 . . . . 0.0 113.378 -177.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.4 p90 -73.88 14.94 0.33 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.841 2.056 . . . . 0.0 114.167 176.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 17.6 pttp -81.43 5.05 18.82 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 127.835 2.454 . . . . 0.0 114.436 -173.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 51.5 m -144.55 -46.59 0.25 Allowed 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 127.066 2.146 . . . . 0.0 110.097 -170.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.5 mt -70.72 159.65 5.56 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 C-N-CA 124.938 1.295 . . . . 0.0 109.223 175.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.5 mmtp 67.73 0.85 2.41 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 126.655 1.982 . . . . 0.0 116.211 177.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.9 mtm -106.66 -42.63 4.92 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 114.845 1.424 . . . . 0.0 114.845 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 47.8 m-85 -84.22 -21.48 31.18 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.792 0.837 . . . . 0.0 113.117 179.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -86.13 137.85 32.36 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.246 1.818 . . . . 0.0 110.939 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.0 m-20 -135.77 155.64 50.05 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.724 1.61 . . . . 0.0 112.0 -176.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -106.92 140.1 40.27 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 125.482 1.513 . . . . 0.0 111.553 172.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.0 t -129.53 -39.34 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 124.824 1.25 . . . . 0.0 111.028 177.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 77.5 p -121.2 15.21 11.43 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.187 1.795 . . . . 0.0 113.707 -178.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 7.8 t 58.04 86.52 0.08 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 126.108 1.763 . . . . 0.0 112.718 -171.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.67 171.24 15.41 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.415 1.486 . . . . 0.0 113.885 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 71.0 m -108.8 172.7 6.69 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.625 1.57 . . . . 0.0 110.632 176.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -59.55 -26.41 65.35 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -146.0 151.64 45.66 Favored Pre-proline 0 CA--C 1.543 0.709 0 C-N-CA 126.891 2.076 . . . . 0.0 110.69 167.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.32 129.46 18.11 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.143 2.562 . . . . 0.0 110.424 169.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -135.27 43.73 2.63 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.325 1.45 . . . . 0.0 111.641 -175.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 18.8 tp -132.71 66.41 76.5 Favored Pre-proline 0 CA--C 1.554 1.116 0 C-N-CA 125.032 1.333 . . . . 0.0 111.417 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.253 1.252 0 C-N-CA 123.939 3.093 . . . . 0.0 113.317 179.325 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.492 0 N-CA-C 110.917 -0.873 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 50.8 m -137.86 152.19 48.82 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.345 1.458 . . . . 0.0 111.579 -177.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 57.2 t60 -100.74 136.22 40.95 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 124.661 1.184 . . . . 0.0 111.176 177.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 94.2 mtp -133.61 102.12 5.37 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.185 1.394 . . . . 0.0 110.395 -177.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.4 -65.27 0.43 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.801 1.24 . . . . 0.0 111.831 175.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 21.4 m 51.76 35.93 16.51 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.536 1.534 . . . . 0.0 114.584 178.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ptm -155.46 -33.29 0.09 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 -176.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -93.19 -10.26 36.4 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.011 1.324 . . . . 0.0 113.166 -175.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.49 19.47 3.35 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 126.402 1.881 . . . . 0.0 111.872 -168.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 11.0 mp -116.81 129.41 56.08 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 125.661 1.585 . . . . 0.0 110.342 178.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -145.68 5.88 1.05 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.438 1.095 . . . . 0.0 113.792 179.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -110.76 91.27 3.59 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.652 1.581 . . . . 0.0 110.279 -178.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -132.36 104.53 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 125.029 1.331 . . . . 0.0 109.059 178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 4.1 mp -138.36 128.27 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.803 0 C-N-CA 125.341 1.456 . . . . 0.0 109.595 -178.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 50.06 44.16 25.74 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.654 1.582 . . . . 0.0 113.468 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -141.06 172.09 13.16 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.871 1.668 . . . . 0.0 112.044 -173.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . 0.326 14.9 tt 50.84 41.05 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 126.4 1.88 . . . . 0.0 114.391 168.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.52 169.03 12.56 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.955 1.302 . . . . 0.0 112.273 177.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -75.37 64.88 1.59 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.894 1.278 . . . . 0.0 111.26 169.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -75.77 97.77 3.96 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 124.934 1.294 . . . . 0.0 110.756 176.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.12 -70.94 0.38 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.125 0.97 . . . . 0.0 112.092 175.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 mt -118.63 3.43 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.629 1.572 . . . . 0.0 112.179 -172.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -81.25 -7.22 59.53 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.566 0.95 . . . . 0.0 113.566 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.4 t -101.18 -55.03 2.65 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.665 1.186 . . . . 0.0 112.991 178.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -71.7 -16.46 62.24 Favored 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 115.155 1.539 . . . . 0.0 115.155 -168.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 71.2 t -74.41 -26.96 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.866 0 C-N-CA 124.861 1.264 . . . . 0.0 112.024 178.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.6 t -96.6 47.15 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.908 1.283 . . . . 0.0 111.408 -175.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 46.4 mt -138.63 145.02 39.99 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.217 1.807 . . . . 0.0 111.553 179.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -133.49 36.9 3.35 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.879 1.672 . . . . 0.0 112.764 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.0 t30 52.01 75.83 0.61 Allowed Pre-proline 0 CA--C 1.556 1.174 0 C-N-CA 126.799 2.04 . . . . 0.0 112.921 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -75.82 76.72 3.61 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 124.17 3.247 . . . . 0.0 112.925 -171.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.76 43.43 28.1 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 126.969 2.107 . . . . 0.0 113.421 174.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 43.1 t 41.77 89.51 0.08 OUTLIER Pre-proline 0 N--CA 1.48 1.071 0 C-N-CA 129.118 2.967 . . . . 0.0 113.321 -178.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -69.16 165.47 30.17 Favored 'Trans proline' 0 CA--C 1.537 0.642 0 C-N-CA 122.457 2.105 . . . . 0.0 113.45 179.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.7 p -128.96 71.9 1.44 Allowed 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.331 1.452 . . . . 0.0 111.917 -155.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -127.85 17.23 6.81 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -170.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.63 72.22 6.79 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.797 1.639 . . . . 0.0 110.772 -170.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.4 t -141.68 11.6 2.07 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 114.795 1.405 . . . . 0.0 114.795 -170.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -81.0 -79.24 0.92 Allowed Glycine 0 CA--C 1.533 1.178 0 O-C-N 120.78 -1.2 . . . . 0.0 112.728 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 63.08 -3.05 0.37 Allowed 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 127.996 2.519 . . . . 0.0 115.64 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.5 mp -144.13 141.44 29.99 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 127.098 2.159 . . . . 0.0 109.69 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 30.3 t -113.25 -73.09 0.68 Allowed 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 126.268 1.827 . . . . 0.0 112.043 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -161.86 -45.86 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 123.28 0.632 . . . . 0.0 111.19 -171.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -63.69 -32.23 73.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.534 0.734 . . . . 0.0 111.124 173.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -67.79 -35.36 78.52 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.129 0.972 . . . . 0.0 111.601 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -69.69 -35.07 74.76 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 121.295 -0.878 . . . . 0.0 112.667 171.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -62.71 -5.98 3.2 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 169.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 14.1 mt -109.27 -24.56 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 125.81 1.644 . . . . 0.0 112.382 174.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.433 HG22 HD22 ' A' ' 60' ' ' LEU . 51.2 t -112.75 -59.59 3.16 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 124.597 1.159 . . . . 0.0 112.598 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.26 -33.11 73.99 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 121.269 -0.894 . . . . 0.0 111.893 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -68.71 -30.85 69.58 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.182 0.993 . . . . 0.0 113.208 171.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -76.65 -37.85 55.57 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.873 1.269 . . . . 0.0 111.623 177.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.47 -40.0 65.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 O-C-N 121.062 -1.023 . . . . 0.0 110.085 167.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.7 m -73.11 -6.22 44.24 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 114.856 1.428 . . . . 0.0 114.856 172.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -110.03 -30.96 7.55 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 120.331 1.423 . . . . 0.0 113.261 -175.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 1.1 p -135.2 -16.54 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 -173.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.96 -83.49 0.28 Allowed Glycine 0 N--CA 1.469 0.886 0 C-N-CA 125.098 1.332 . . . . 0.0 111.683 171.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.3 tt -166.31 -44.48 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 126.082 1.753 . . . . 0.0 110.551 177.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -107.55 -6.73 16.81 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.224 1.81 . . . . 0.0 115.155 -168.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -93.36 -16.94 24.1 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 118.911 0.778 . . . . 0.0 112.862 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.8 pp -63.46 163.76 10.37 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.181 1.392 . . . . 0.0 112.754 167.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 21.4 p30 -112.69 170.6 8.07 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 122.233 1.016 . . . . 0.0 111.47 170.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -21.66 31.72 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.424 1.089 . . . . 0.0 112.72 179.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.9 m -65.24 -45.35 85.0 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.809 1.643 . . . . 0.0 112.219 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -65.46 -36.48 84.0 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 120.556 -1.34 . . . . 0.0 111.993 176.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.433 HD22 HG22 ' A' ' 43' ' ' VAL . 47.2 mt -65.89 -47.25 75.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.182 0.593 . . . . 0.0 112.146 173.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.8 p -63.9 -31.05 72.1 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.11 -0.994 . . . . 0.0 113.036 179.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -71.47 -43.6 66.33 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.338 1.455 . . . . 0.0 112.834 176.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -94.78 -37.11 11.41 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -173.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -86.28 -15.36 40.95 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 125.446 1.499 . . . . 0.0 111.568 179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 59.82 67.18 0.9 Allowed 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 126.244 1.818 . . . . 0.0 112.657 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.1 pt -136.87 161.64 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 128.399 2.68 . . . . 0.0 109.022 -178.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 70' ' ' LYS . 15.3 t -68.4 153.17 44.29 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 121.364 -0.835 . . . . 0.0 110.751 167.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.99 59.22 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.679 0.792 . . . . 0.0 111.126 -176.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.06 -31.5 70.3 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.967 1.099 . . . . 0.0 113.967 178.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.407 ' H ' HG23 ' A' ' 67' ' ' THR . 27.7 mttm -64.93 -40.69 95.44 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.62 170.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.33 -49.18 65.13 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.651 0.66 . . . . 0.0 110.64 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 49.8 mtpt -54.35 -42.47 70.29 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.438 1.495 . . . . 0.0 112.483 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.4 t -85.15 -38.06 19.47 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 118.509 0.595 . . . . 0.0 112.526 -178.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -61.74 -35.73 78.93 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 121.054 -1.029 . . . . 0.0 112.984 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 37.9 mt -47.69 -55.27 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 124.194 0.998 . . . . 0.0 110.719 172.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -77.4 -30.32 53.53 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.228 1.195 . . . . 0.0 114.228 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 25.3 m120 -67.85 -35.02 77.83 Favored 'General case' 0 N--CA 1.472 0.653 0 CA-C-N 120.098 1.317 . . . . 0.0 112.268 175.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.2 t -77.11 -45.91 25.33 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.337 1.055 . . . . 0.0 112.116 178.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -149.53 83.13 1.41 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.446 1.098 . . . . 0.0 112.164 -178.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.6 ttp85 -67.51 -61.84 1.7 Allowed 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.844 -1.16 . . . . 0.0 112.545 178.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 51.0 mtt -158.21 39.78 0.26 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 127.838 2.455 . . . . 0.0 110.242 -171.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -87.77 -125.77 2.26 Favored Glycine 0 CA--C 1.528 0.881 0 O-C-N 120.895 -1.128 . . . . 0.0 111.525 -175.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -94.89 34.43 1.36 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.075 1.75 . . . . 0.0 112.072 175.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 50.75 29.0 3.92 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.918 2.087 . . . . 0.0 113.263 -176.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 44.75 36.73 1.93 Allowed 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 126.095 1.758 . . . . 0.0 114.707 -168.322 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.27 -5.65 24.03 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 125.021 1.329 . . . . 0.0 113.851 177.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.8 p90 -71.63 17.25 0.09 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 126.634 1.974 . . . . 0.0 114.082 174.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 38.9 pttt -84.46 -10.4 57.53 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 128.056 2.542 . . . . 0.0 113.116 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 85.4 m -137.03 -42.7 0.57 Allowed 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 126.558 1.943 . . . . 0.0 111.24 -175.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.5 mt -71.19 153.42 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 123.829 0.852 . . . . 0.0 108.881 167.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm 66.68 -4.66 0.72 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 116.909 2.188 . . . . 0.0 116.909 170.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.6 ptt? -82.18 -26.89 32.99 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.939 0.79 . . . . 0.0 113.032 173.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -114.91 -10.67 12.29 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.063 1.345 . . . . 0.0 113.95 -175.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -94.79 149.6 21.07 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 125.406 1.482 . . . . 0.0 111.988 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -87.9 114.81 24.87 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.802 0.841 . . . . 0.0 110.691 172.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -138.18 145.5 41.57 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.85 1.66 . . . . 0.0 111.36 177.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 37.8 t -135.98 -50.1 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.681 1.192 . . . . 0.0 111.516 173.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 23.6 m -120.3 24.48 10.37 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.056 1.343 . . . . 0.0 113.324 -175.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.8 t 54.25 49.78 17.84 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.634 1.574 . . . . 0.0 113.678 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.06 165.36 23.68 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.776 1.23 . . . . 0.0 113.275 179.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.5 t -139.12 -173.02 3.47 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.287 1.435 . . . . 0.0 110.514 176.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -74.44 56.71 0.68 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.892 1.677 . . . . 0.0 112.621 176.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 41.2 mm-40 -71.84 149.32 92.68 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.045 1.738 . . . . 0.0 112.366 -176.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -77.15 79.19 3.21 Favored 'Trans proline' 0 CA--C 1.543 0.941 0 C-N-CA 124.118 3.212 . . . . 0.0 111.283 177.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -140.44 95.41 2.87 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.763 1.625 . . . . 0.0 109.898 -176.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 21.1 tp -130.88 68.1 81.45 Favored Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 125.381 1.473 . . . . 0.0 111.363 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo . . . . . 0 C--O 1.254 1.313 0 C-N-CA 124.11 3.207 . . . . 0.0 113.269 179.384 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.581 0 N-CA-C 111.698 -0.561 . . . . 0.0 111.698 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 11.2 t -146.79 145.84 30.05 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.103 1.361 . . . . 0.0 111.346 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -148.06 33.16 0.82 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.665 1.186 . . . . 0.0 112.584 -170.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 26.4 mmt -97.67 76.32 2.49 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.054 1.342 . . . . 0.0 111.377 -172.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.67 73.2 0.33 Allowed 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 126.646 1.979 . . . . 0.0 113.735 -178.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 57.5 p -49.42 -34.3 16.15 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 127.07 2.148 . . . . 0.0 114.76 -174.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.8 mtp -67.47 -10.69 53.88 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.389 1.476 . . . . 0.0 114.276 179.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -123.57 9.72 9.02 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 127.81 2.444 . . . . 0.0 112.097 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.58 20.66 2.02 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 126.288 1.835 . . . . 0.0 111.887 -163.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.5 mp -118.58 120.9 38.84 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 125.61 1.564 . . . . 0.0 110.839 176.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -147.17 2.58 0.77 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 125.136 1.374 . . . . 0.0 113.343 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -119.47 89.33 3.11 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.156 1.782 . . . . 0.0 109.704 -174.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 28.8 mm -123.57 136.41 60.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 125.802 1.641 . . . . 0.0 109.52 -174.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.7 mm -96.25 128.92 47.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.207 1.003 . . . . 0.0 110.657 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -139.08 14.26 2.64 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.98 1.312 . . . . 0.0 112.596 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -85.37 169.5 13.63 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -173.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 10.7 tt -93.86 12.61 3.09 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 126.534 1.934 . . . . 0.0 114.115 178.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -141.31 158.37 43.98 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 125.602 1.561 . . . . 0.0 112.357 -169.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -89.83 36.8 0.86 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 125.256 1.423 . . . . 0.0 113.162 -177.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -144.18 145.82 32.33 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.635 1.574 . . . . 0.0 111.703 178.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -143.83 -96.3 0.11 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.391 1.876 . . . . 0.0 110.192 -166.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.5 mp -136.54 54.29 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.499 1.919 . . . . 0.0 107.862 179.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -128.28 8.45 6.04 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.779 1.632 . . . . 0.0 112.217 174.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.3 t -134.64 -54.02 0.82 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.492 1.117 . . . . 0.0 112.742 -176.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 52.2 p-10 -60.27 -22.68 63.4 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 175.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.6 p -85.5 -13.51 11.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 126.72 2.008 . . . . 0.0 113.302 178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.2 t -129.98 52.63 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 125.732 1.613 . . . . 0.0 109.99 173.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.7 tp -89.06 155.85 19.21 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 124.449 1.1 . . . . 0.0 111.849 178.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -121.9 24.49 9.6 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.691 1.596 . . . . 0.0 114.883 -171.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.5 t30 51.02 74.46 0.8 Allowed Pre-proline 0 CA--C 1.553 1.076 0 C-N-CA 126.452 1.901 . . . . 0.0 113.022 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -65.74 94.86 0.28 Allowed 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.741 2.961 . . . . 0.0 113.006 -171.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 22.1 mmt85 -137.55 -43.21 0.54 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.924 2.09 . . . . 0.0 112.69 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 20.9 t -126.41 86.34 58.45 Favored Pre-proline 0 N--CA 1.479 1.005 0 C-N-CA 124.338 1.055 . . . . 0.0 111.134 -178.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -76.16 173.06 15.11 Favored 'Trans proline' 0 CA--C 1.54 0.812 0 C-N-CA 123.639 2.893 . . . . 0.0 113.155 172.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.8 p -119.94 68.32 0.83 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.073 1.749 . . . . 0.0 112.804 -164.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.6 mt-30 -113.39 30.04 7.52 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.288 1.435 . . . . 0.0 113.41 -174.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.406 ' HA ' ' HE2' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -75.9 39.91 0.19 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.337 1.855 . . . . 0.0 113.924 -174.621 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.8 t -117.93 -5.34 11.03 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 125.778 1.631 . . . . 0.0 114.901 -171.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -73.22 -54.06 7.22 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.623 1.106 . . . . 0.0 113.148 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 58.07 32.97 22.68 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.883 1.673 . . . . 0.0 114.318 175.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -107.23 96.1 6.18 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.038 1.735 . . . . 0.0 111.317 -170.72 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.2 m -134.05 71.36 1.45 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 126.662 1.985 . . . . 0.0 111.3 -173.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 66.44 8.76 5.97 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 116.918 2.192 . . . . 0.0 116.918 163.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -128.44 -32.6 2.18 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.27 1.028 . . . . 0.0 111.903 171.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.3 mp0 -76.1 -42.71 46.33 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.978 1.311 . . . . 0.0 111.407 -170.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.25 -31.02 72.06 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.179 0.992 . . . . 0.0 112.846 166.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 90.7 mttt -68.21 -3.48 10.8 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 169.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -103.54 -55.96 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 C-N-CA 125.287 1.435 . . . . 0.0 109.579 166.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.8 t -74.18 -50.69 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 CA-C-N 119.308 0.958 . . . . 0.0 113.075 -170.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.09 -34.72 78.25 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.88 0.764 . . . . 0.0 111.084 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -61.05 -35.52 77.15 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 170.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.51 -39.72 70.6 Favored 'General case' 0 CA--C 1.545 0.781 0 O-C-N 121.182 -0.949 . . . . 0.0 111.521 174.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.12 -36.82 58.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 O-C-N 120.601 -1.312 . . . . 0.0 110.944 172.235 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 68.8 m -70.83 -11.49 60.99 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 171.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -104.48 -42.24 5.5 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 120.318 1.417 . . . . 0.0 112.873 -172.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.9 m -128.81 -13.36 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -172.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.49 -79.2 0.34 Allowed Glycine 0 N--CA 1.47 0.923 0 C-N-CA 125.075 1.322 . . . . 0.0 112.504 164.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 tp -159.8 -47.33 0.05 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.371 1.068 . . . . 0.0 112.143 177.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.9 m-80 -106.34 -13.39 15.39 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.684 1.594 . . . . 0.0 114.307 -170.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -87.16 -11.04 51.15 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -171.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.4 pp -69.9 175.1 4.59 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.166 1.786 . . . . 0.0 113.975 174.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -117.68 120.85 39.26 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.083 0.953 . . . . 0.0 111.964 -178.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -63.11 -24.91 68.12 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.289 0.636 . . . . 0.0 112.641 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 58.0 m -69.38 -43.6 73.19 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.9 1.28 . . . . 0.0 112.1 173.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -63.51 -38.51 91.4 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.266 -1.521 . . . . 0.0 111.763 173.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.73 -51.29 69.98 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.775 0.43 . . . . 0.0 111.633 172.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 98.6 p -65.26 -26.8 68.25 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 113.652 0.982 . . . . 0.0 113.652 -178.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -74.17 -46.44 42.23 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.608 1.563 . . . . 0.0 112.07 175.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.3 mmt-85 -72.8 -42.9 63.41 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.846 1.258 . . . . 0.0 113.127 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -92.38 -20.34 21.15 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.102 1.761 . . . . 0.0 112.249 -170.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 62.25 68.17 0.69 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.279 1.832 . . . . 0.0 112.844 -178.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.5 pt -132.35 173.97 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 128.55 2.74 . . . . 0.0 108.527 174.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.423 HG23 ' H ' ' A' ' 70' ' ' LYS . 12.7 t -78.36 152.94 32.04 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 121.126 -0.983 . . . . 0.0 110.573 165.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.6 t -57.49 -36.45 53.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.093 0.957 . . . . 0.0 111.134 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.46 -33.8 75.87 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.423 ' H ' HG23 ' A' ' 67' ' ' THR . 43.6 mtmt -69.2 -33.45 73.37 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 118.049 -0.976 . . . . 0.0 111.396 172.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -69.22 -49.67 54.26 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.548 1.067 . . . . 0.0 110.679 174.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -55.15 -39.23 69.25 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.439 1.496 . . . . 0.0 112.796 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.6 t -83.88 -41.16 17.73 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 175.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.3 t80 -59.93 -34.32 73.08 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 120.862 -1.149 . . . . 0.0 112.835 -179.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.5 mt -48.09 -64.27 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.657 1.183 . . . . 0.0 110.408 171.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.71 -21.98 60.96 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.863 1.06 . . . . 0.0 113.863 -179.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -79.99 -31.44 39.75 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 119.081 0.855 . . . . 0.0 112.725 -178.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 t -94.22 -45.3 7.58 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.159 1.384 . . . . 0.0 112.89 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -126.19 81.27 1.98 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.052 1.341 . . . . 0.0 112.324 -175.185 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.02 -4.03 50.3 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 125.568 1.547 . . . . 0.0 114.554 171.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 69.3 mtm -81.81 59.69 4.36 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.058 1.343 . . . . 0.0 112.731 -172.703 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -88.49 -114.29 1.24 Allowed Glycine 0 CA--C 1.53 1.031 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 169.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.9 mtt85 -109.31 61.55 0.6 Allowed 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 125.513 1.525 . . . . 0.0 111.999 172.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 25.3 p 53.03 23.35 2.89 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 165.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 48.94 25.98 1.21 Allowed 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 125.83 1.652 . . . . 0.0 114.77 -166.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.52 -8.81 28.31 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.493 1.517 . . . . 0.0 113.805 -178.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -70.9 15.36 0.11 Allowed 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 127.367 2.267 . . . . 0.0 115.569 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -77.39 1.87 17.69 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 126.703 2.001 . . . . 0.0 114.756 -172.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.4 m -147.6 -48.89 0.17 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.707 2.003 . . . . 0.0 110.297 -170.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.7 mt -71.31 156.37 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 C-N-CA 124.649 1.18 . . . . 0.0 109.533 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? 68.23 -4.92 0.97 Allowed 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 126.991 2.116 . . . . 0.0 116.118 -178.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 48.7 mtm -102.99 -43.09 5.61 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 114.594 1.331 . . . . 0.0 114.594 -173.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -94.11 -9.07 37.74 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -97.21 150.47 20.87 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.325 1.45 . . . . 0.0 112.222 -175.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -138.34 152.52 48.54 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 125.63 1.572 . . . . 0.0 111.173 176.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -143.17 148.71 36.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.023 1.329 . . . . 0.0 112.1 174.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 42.4 t -135.39 -47.24 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 124.957 1.303 . . . . 0.0 111.205 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 25.1 m -119.75 26.48 9.31 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.411 1.484 . . . . 0.0 113.169 -176.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.8 t 55.99 38.14 29.62 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.824 1.65 . . . . 0.0 114.328 -179.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.37 125.75 29.83 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 121.179 -0.951 . . . . 0.0 111.805 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.6 m -145.55 118.5 8.77 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.447 1.499 . . . . 0.0 109.876 179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 54.14 24.48 4.89 Favored 'General case' 0 CA--C 1.551 1.005 0 C-N-CA 125.716 1.606 . . . . 0.0 115.176 -177.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 50.8 mm-40 -124.58 98.33 37.71 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 125.833 1.653 . . . . 0.0 110.99 -177.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -80.05 64.52 8.87 Favored 'Trans proline' 0 CA--C 1.544 0.99 0 C-N-CA 124.324 3.349 . . . . 0.0 111.641 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.08 38.83 3.56 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 125.861 1.664 . . . . 0.0 112.023 -172.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 90.7 mt -133.68 150.62 75.29 Favored Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 125.858 1.663 . . . . 0.0 111.495 -179.209 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.253 1.235 0 C-N-CA 124.088 3.192 . . . . 0.0 113.426 179.024 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.595 0 N-CA-C 112.117 -0.393 . . . . 0.0 112.117 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 12.2 t -147.5 158.2 43.89 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.501 1.52 . . . . 0.0 111.245 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -118.93 119.19 33.59 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.908 1.283 . . . . 0.0 111.055 -179.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 60.9 mtt -135.4 113.11 10.88 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 125.174 1.39 . . . . 0.0 110.091 175.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -144.31 -63.78 0.37 Allowed 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.752 1.221 . . . . 0.0 111.565 174.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 20.3 m 53.07 31.63 11.56 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.682 1.593 . . . . 0.0 114.93 177.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.94 -25.64 0.12 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -93.63 -7.51 43.7 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.431 1.492 . . . . 0.0 113.306 -178.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.05 33.75 1.55 Allowed 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 125.856 1.663 . . . . 0.0 111.587 -164.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.5 mp -104.33 87.43 2.73 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.398 1.479 . . . . 0.0 110.22 -178.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 20.7 m-20 -127.69 -0.81 6.1 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.173 1.389 . . . . 0.0 113.804 -176.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -102.73 89.1 3.38 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.905 1.282 . . . . 0.0 111.971 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.9 mp -134.57 -47.94 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 178.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 20.2 tt -150.04 149.23 14.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.955 1.302 . . . . 0.0 111.52 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.7 mp0 -113.0 148.32 35.32 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.456 1.503 . . . . 0.0 111.55 177.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -150.92 156.27 40.85 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.915 1.286 . . . . 0.0 111.172 -177.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.7 pt -85.25 77.07 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.911 0 C-N-CA 124.826 1.25 . . . . 0.0 112.777 -176.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -152.21 156.62 40.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.395 1.478 . . . . 0.0 111.734 -174.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -92.85 61.5 3.55 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.697 1.199 . . . . 0.0 111.454 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -134.3 138.11 44.74 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.218 1.007 . . . . 0.0 111.155 174.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.42 -77.45 0.31 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.615 1.566 . . . . 0.0 110.967 178.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 69.8 mt -121.86 -10.06 8.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.792 1.237 . . . . 0.0 113.597 -174.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 -74.0 -16.13 61.08 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -172.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 35.1 t -88.71 -53.34 4.67 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 124.305 1.042 . . . . 0.0 112.136 179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -71.08 -18.01 62.57 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 114.292 1.219 . . . . 0.0 114.292 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 86.6 t -87.12 -26.83 5.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.097 1.359 . . . . 0.0 111.963 175.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.6 t -132.08 79.83 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 125.232 1.413 . . . . 0.0 110.155 -174.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.8 tp -132.58 147.97 52.36 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.144 1.378 . . . . 0.0 111.955 -177.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -121.65 42.15 3.17 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.572 1.549 . . . . 0.0 113.322 -175.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 t30 49.8 64.61 8.2 Favored Pre-proline 0 CA--C 1.556 1.197 0 C-N-CA 126.469 1.907 . . . . 0.0 114.247 176.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.28 88.53 0.48 Allowed 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.923 3.082 . . . . 0.0 112.159 -176.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.3 mmp_? -127.25 -50.55 1.42 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.151 1.78 . . . . 0.0 113.501 -178.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 44.6 t 48.25 83.37 0.22 Allowed Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 127.802 2.441 . . . . 0.0 112.978 175.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -66.59 158.86 53.65 Favored 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.494 2.796 . . . . 0.0 113.446 -178.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.2 t -113.88 79.73 1.29 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.739 1.615 . . . . 0.0 111.502 -169.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -104.56 32.6 3.98 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 125.821 1.649 . . . . 0.0 112.781 -178.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.72 33.76 0.08 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 127.152 2.181 . . . . 0.0 115.024 -173.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.0 t -138.23 13.5 2.82 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.137 1.375 . . . . 0.0 114.414 -162.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -146.26 25.82 1.71 Allowed Glycine 0 CA--C 1.535 1.336 0 O-C-N 120.788 -1.195 . . . . 0.0 115.793 -172.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -76.11 -53.19 8.68 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 118.746 1.273 . . . . 0.0 113.365 -173.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp -145.19 141.84 29.05 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 126.969 2.108 . . . . 0.0 108.968 174.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 66.5 m -120.46 -66.76 1.03 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.802 1.641 . . . . 0.0 112.162 177.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -163.6 -48.91 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.257 0.551 . . . . 0.0 110.453 -170.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -31.61 72.89 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.937 177.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -68.92 -34.42 75.36 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.185 0.994 . . . . 0.0 111.921 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -69.63 -33.62 72.9 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.88 -1.138 . . . . 0.0 111.847 171.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -67.09 -1.16 3.9 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 170.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 9.1 mt -112.53 -26.86 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 126.523 1.929 . . . . 0.0 112.44 171.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 40.2 t -107.95 -59.91 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.749 1.159 . . . . 0.0 112.378 -176.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.26 -39.37 93.81 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.767 0.827 . . . . 0.0 111.701 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -66.47 -38.44 87.33 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 174.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -71.38 -32.05 68.01 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.619 1.168 . . . . 0.0 112.677 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.56 -31.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.08 0.952 . . . . 0.0 111.768 167.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.0 t -74.71 -17.16 60.7 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.479 0.712 . . . . 0.0 112.86 176.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -90.61 -44.21 9.68 Favored 'General case' 0 N--CA 1.467 0.394 0 O-C-N 121.223 -0.923 . . . . 0.0 111.318 176.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 84.9 t -108.12 -48.85 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -167.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.34 -79.84 0.18 Allowed Glycine 0 N--CA 1.469 0.894 0 CA-C-N 118.182 0.446 . . . . 0.0 114.053 170.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 tt -172.63 -39.3 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.805 1.642 . . . . 0.0 113.331 -173.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -121.62 -9.69 8.89 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.616 1.567 . . . . 0.0 114.984 -168.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -101.92 -3.29 28.09 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -172.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.3 mp -69.38 157.43 37.06 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 126.59 1.956 . . . . 0.0 113.961 -170.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -85.38 104.93 15.65 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.214 1.006 . . . . 0.0 109.726 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -58.78 -24.39 61.72 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.347 0.659 . . . . 0.0 112.349 171.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.7 m -58.67 -46.03 88.1 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 126.426 1.89 . . . . 0.0 112.405 169.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -63.63 -37.64 88.11 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.307 -1.495 . . . . 0.0 112.423 175.57 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.19 -49.82 70.53 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 118.566 0.621 . . . . 0.0 112.174 173.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 79.1 p -64.53 -22.96 67.11 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.235 -0.916 . . . . 0.0 113.468 -179.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.6 mtpp -81.76 -14.47 56.41 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 125.608 1.563 . . . . 0.0 113.751 175.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.3 mmt-85 -119.99 -42.18 2.61 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.227 1.411 . . . . 0.0 113.582 -172.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.1 mp -85.85 -12.01 51.88 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.868 1.267 . . . . 0.0 112.603 172.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.1 t30 58.67 63.97 1.55 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.313 1.445 . . . . 0.0 111.905 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.5 pt -128.22 167.19 23.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 126.937 2.095 . . . . 0.0 111.45 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 18.8 m -63.86 141.46 58.76 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.72 1.208 . . . . 0.0 109.721 167.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 14.4 t -59.74 -36.94 68.86 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 O-C-N 121.251 -0.905 . . . . 0.0 111.437 -178.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -72.83 -28.71 62.71 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 177.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -66.05 -40.07 90.63 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 118.524 -0.75 . . . . 0.0 110.519 168.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.75 -47.82 73.95 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 118.91 0.777 . . . . 0.0 111.14 176.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -55.51 -38.69 69.53 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.451 1.5 . . . . 0.0 112.942 178.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.9 t -88.76 -34.95 16.94 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 112.991 0.738 . . . . 0.0 112.991 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -63.96 -34.91 79.05 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.73 1.212 . . . . 0.0 112.884 178.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.6 mt -50.29 -36.36 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.735 1.214 . . . . 0.0 112.096 173.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 24.6 mtmm -92.01 -43.95 9.14 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.969 0.908 . . . . 0.0 112.799 174.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.1 m-80 -68.24 -23.54 64.8 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -172.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.1 t -84.89 -37.45 20.59 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.232 1.013 . . . . 0.0 113.509 173.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -145.45 54.23 1.19 Allowed 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -168.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -58.23 -30.96 66.93 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -172.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 61.1 mtm -127.74 -9.87 5.56 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 125.342 1.457 . . . . 0.0 113.889 178.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 96.51 132.49 7.28 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.234 1.397 . . . . 0.0 112.116 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 48.3 33.15 3.58 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 125.945 1.698 . . . . 0.0 113.71 -178.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 46.88 30.66 1.27 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 127.308 2.243 . . . . 0.0 113.818 -174.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 56.5 7.92 0.4 Allowed 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 126.72 2.008 . . . . 0.0 115.543 -172.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -12.44 59.99 Favored 'General case' 0 CA--C 1.549 0.929 0 O-C-N 119.992 -1.692 . . . . 0.0 113.906 -173.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.6 p90 -72.61 13.15 0.39 Allowed 'General case' 0 CA--C 1.552 1.019 0 C-N-CA 127.085 2.154 . . . . 0.0 114.835 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 36.4 pttt -91.32 -4.3 55.96 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 127.727 2.411 . . . . 0.0 114.64 -167.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 63.6 m -138.61 -49.36 0.53 Allowed 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 125.994 1.718 . . . . 0.0 110.343 -172.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 44.1 pt -70.44 164.67 3.02 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.49 1.116 . . . . 0.0 111.873 176.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 65.14 -9.54 0.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 127.263 2.225 . . . . 0.0 116.346 -179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 46.0 mtm -93.29 -39.49 10.94 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.781 1.173 . . . . 0.0 113.945 -175.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -120.69 0.84 10.49 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -173.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -81.85 109.02 15.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.477 1.111 . . . . 0.0 111.149 -175.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 -142.76 156.68 45.03 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.002 1.721 . . . . 0.0 111.547 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 26.3 m-20 -110.6 142.28 42.66 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.184 1.393 . . . . 0.0 111.724 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -131.71 -42.56 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 124.727 1.211 . . . . 0.0 111.627 -179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 18.1 t -65.77 -35.57 81.08 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.616 0.766 . . . . 0.0 112.32 177.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 65.3 m -100.48 113.41 26.18 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.706 1.602 . . . . 0.0 110.542 171.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -150.87 154.03 36.46 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.306 1.443 . . . . 0.0 111.577 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.2 m -142.87 136.78 29.02 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.963 1.305 . . . . 0.0 111.064 -177.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 55.1 16.14 1.47 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.051 1.74 . . . . 0.0 115.596 -177.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 61.8 mm-40 -83.05 126.6 72.05 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 124.294 1.037 . . . . 0.0 111.103 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -82.81 56.07 5.5 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.265 3.31 . . . . 0.0 112.504 -175.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -119.46 69.44 0.83 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.559 1.544 . . . . 0.0 111.552 -171.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 93.7 mt -125.7 87.81 55.25 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.8 1.64 . . . . 0.0 110.212 177.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo . . . . . 0 C--O 1.252 1.191 0 C-N-CA 123.915 3.077 . . . . 0.0 113.313 -179.509 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.642 0 N-CA-C 111.566 -0.613 . . . . 0.0 111.566 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 4.4 t -135.06 48.05 2.3 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.82 1.248 . . . . 0.0 112.329 -176.125 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 51.93 43.46 30.22 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 126.112 1.765 . . . . 0.0 113.409 -179.762 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 80.9 mtp -75.46 111.45 10.77 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.851 1.261 . . . . 0.0 110.145 -178.094 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -143.73 -49.53 0.3 Allowed 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 124.215 1.006 . . . . 0.0 113.024 -176.544 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 8.0 t 63.34 -39.1 0.18 Allowed 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 128.831 2.852 . . . . 0.0 117.242 176.427 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.6 ptt? -114.26 0.39 14.16 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.198 1.555 . . . . 0.0 115.198 -174.471 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -118.77 1.68 11.59 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.426 1.49 . . . . 0.0 114.038 -177.426 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -122.86 13.91 9.93 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.004 1.483 . . . . 0.0 115.004 -171.278 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -83.9 -47.11 11.39 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.051 0.94 . . . . 0.0 113.118 -177.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -105.53 -22.99 12.88 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -173.354 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -115.16 127.79 55.77 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.864 1.665 . . . . 0.0 109.1 172.073 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.1 mp -134.83 120.0 29.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.684 1.194 . . . . 0.0 109.523 -172.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.1 mm -136.06 142.41 38.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 126.341 1.856 . . . . 0.0 109.578 -173.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 51.24 60.66 3.71 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 125.857 1.663 . . . . 0.0 113.675 176.465 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -126.09 -61.21 1.24 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.465 1.106 . . . . 0.0 112.816 -177.384 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 10.3 pt -135.68 111.81 12.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.247 1.419 . . . . 0.0 110.915 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.5 pm0 -156.06 -176.96 6.23 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.963 2.105 . . . . 0.0 109.73 177.532 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -58.86 -21.07 56.21 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -170.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -146.59 152.54 39.09 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 126.046 1.738 . . . . 0.0 110.606 173.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -128.56 -76.41 0.56 Allowed 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.782 1.233 . . . . 0.0 111.108 176.388 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.1 mt -127.87 -12.05 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -174.388 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 72.4 m-80 -79.86 -11.44 59.81 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -175.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.2 p -88.08 -49.32 7.11 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.781 1.232 . . . . 0.0 112.92 -176.843 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 14.0 p30 -66.79 -16.31 64.18 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -175.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 94.6 t -73.39 -26.17 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 C-N-CA 125.567 1.547 . . . . 0.0 111.843 174.015 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 8.7 t -130.06 64.26 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 125.777 1.631 . . . . 0.0 109.4 -177.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.6 tp -136.39 148.84 48.02 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.129 1.372 . . . . 0.0 111.915 -174.075 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -112.53 53.41 0.74 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.385 1.874 . . . . 0.0 111.323 -172.123 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 44.63 77.52 0.45 Allowed Pre-proline 0 CA--C 1.554 1.109 0 C-N-CA 127.017 2.127 . . . . 0.0 114.691 171.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -75.02 80.0 2.54 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.562 2.841 . . . . 0.0 112.968 -173.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 70.5 mtp85 -131.25 -58.02 1.01 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.721 1.608 . . . . 0.0 112.868 174.877 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 14.4 t -136.86 78.93 40.58 Favored Pre-proline 0 N--CA 1.481 1.116 0 C-N-CA 124.487 1.115 . . . . 0.0 111.117 -174.94 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -74.0 168.03 25.77 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.036 2.49 . . . . 0.0 112.814 170.703 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.6 p -106.53 50.13 0.78 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 126.645 1.978 . . . . 0.0 113.63 -169.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.67 17.01 0.96 Allowed 'General case' 0 CA--C 1.546 0.814 0 N-CA-C 116.513 2.042 . . . . 0.0 116.513 -172.816 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -81.34 62.81 5.41 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 126.766 2.027 . . . . 0.0 112.239 -171.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.2 t -138.43 4.35 2.4 Favored 'General case' 0 N--CA 1.481 1.088 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -172.076 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 161.11 69.05 0.02 OUTLIER Glycine 0 N--CA 1.472 1.083 0 O-C-N 120.889 -1.132 . . . . 0.0 114.121 178.393 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -129.93 -90.82 0.46 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.222 1.009 . . . . 0.0 110.998 178.181 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 9.8 mp -105.2 99.49 9.1 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 125.067 1.347 . . . . 0.0 110.348 -176.481 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.5 t -92.06 -69.79 0.72 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 114.226 -1.352 . . . . 0.0 111.312 179.098 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -161.8 -29.95 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -175.64 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -99.39 0.07 41.99 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.996 1.318 . . . . 0.0 112.311 177.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -106.39 -37.11 6.61 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 119.189 0.904 . . . . 0.0 112.87 175.603 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.9 ptpt -65.15 -29.41 70.24 Favored 'General case' 0 N--CA 1.478 0.958 0 O-C-N 120.776 -1.202 . . . . 0.0 112.515 174.331 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -65.66 -6.38 11.16 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.829 1.252 . . . . 0.0 114.147 170.263 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 4.0 mp -104.89 -55.81 5.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 C-N-CA 125.52 1.528 . . . . 0.0 110.116 167.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 45.9 t -65.05 -55.93 18.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 CA-C-N 119.435 1.016 . . . . 0.0 111.613 -172.324 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.96 65.04 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -175.397 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -60.36 -34.4 73.8 Favored 'General case' 0 CA--C 1.544 0.736 0 O-C-N 121.645 -0.659 . . . . 0.0 112.572 166.849 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.72 -37.95 70.57 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.25 0.932 . . . . 0.0 111.796 172.711 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -60.16 -31.16 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 O-C-N 120.491 -1.381 . . . . 0.0 110.899 173.053 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.7 t -74.28 -13.17 60.73 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 114.408 1.262 . . . . 0.0 114.408 171.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -102.05 -43.98 5.6 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 120.529 -1.357 . . . . 0.0 112.959 -167.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.5 m -130.06 -11.7 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -169.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 135.47 -86.44 0.25 Allowed Glycine 0 N--CA 1.47 0.94 0 C-N-CA 124.767 1.175 . . . . 0.0 111.462 170.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -162.56 -44.74 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.599 1.56 . . . . 0.0 111.109 176.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -104.24 -13.44 16.18 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.516 1.526 . . . . 0.0 114.596 -168.591 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -85.99 -16.28 38.82 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.112 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -66.33 159.78 26.03 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.981 1.312 . . . . 0.0 113.815 179.12 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 57.2 t-20 -104.23 117.97 35.51 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.225 1.01 . . . . 0.0 110.747 178.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -61.56 -24.4 66.62 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.519 1.127 . . . . 0.0 113.63 178.84 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.6 m -68.22 -40.72 81.99 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.041 0.936 . . . . 0.0 111.769 173.638 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 68.3 mm-40 -68.01 -29.19 68.13 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 120.353 -1.467 . . . . 0.0 113.007 176.474 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.1 mp -65.64 -57.71 7.47 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.932 0.893 . . . . 0.0 111.345 165.616 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 86.0 p -60.44 -24.64 65.36 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.38 1.072 . . . . 0.0 113.657 -174.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -67.98 -24.51 65.15 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 126.496 1.918 . . . . 0.0 114.257 173.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 6.9 mtm-85 -112.65 -37.08 5.01 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 125.818 1.647 . . . . 0.0 113.411 -179.672 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.7 mp -73.8 -17.83 61.03 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.108 0.963 . . . . 0.0 112.45 171.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 57.69 49.9 11.65 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 125.64 1.576 . . . . 0.0 111.626 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 7.0 pt -113.98 175.37 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 127.254 2.222 . . . . 0.0 110.952 179.201 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.4 m -71.96 137.57 47.41 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 125.726 1.61 . . . . 0.0 108.854 165.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.5 t -57.04 -40.13 70.82 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 O-C-N 121.782 -0.574 . . . . 0.0 111.139 -178.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -71.18 -26.95 63.19 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 179.335 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -68.23 -39.33 82.34 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.739 168.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.05 -49.09 73.7 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.461 1.028 . . . . 0.0 110.433 175.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 mtpt -54.55 -41.42 69.76 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.492 1.517 . . . . 0.0 112.866 -179.503 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -87.08 -33.32 19.53 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 177.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -61.91 -38.94 90.26 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.072 -1.017 . . . . 0.0 112.508 178.072 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 31.7 mt -46.86 -58.04 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.093 1.357 . . . . 0.0 110.358 173.581 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -72.89 -33.21 65.9 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 113.518 0.932 . . . . 0.0 113.518 -179.413 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -67.52 -33.31 74.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.202 0.91 . . . . 0.0 113.181 -178.704 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 22.6 m -91.25 -36.98 13.59 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.921 1.082 . . . . 0.0 113.921 175.193 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -143.65 89.92 2.11 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.734 0.814 . . . . 0.0 112.411 -178.432 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.49 -0.78 51.85 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 115.07 1.508 . . . . 0.0 115.07 167.714 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 23.8 ptp -84.63 21.01 1.6 Allowed 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -170.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -79.12 -57.57 3.17 Favored Glycine 0 N--CA 1.474 1.227 0 O-C-N 120.989 -1.07 . . . . 0.0 114.233 -170.126 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -140.37 53.08 1.64 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.522 1.529 . . . . 0.0 110.827 170.612 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.8 p 53.82 23.8 4.05 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 115.498 1.666 . . . . 0.0 115.498 167.546 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 48.55 27.31 1.42 Allowed 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 126.317 1.847 . . . . 0.0 114.388 -168.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.8 -10.33 24.97 Favored 'General case' 0 CA--C 1.548 0.869 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 -176.738 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -70.72 10.72 0.46 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.197 2.199 . . . . 0.0 116.38 -169.302 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -87.1 -9.56 55.04 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 126.322 1.849 . . . . 0.0 114.817 -169.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 99.1 m -140.56 -44.09 0.4 Allowed 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.778 1.631 . . . . 0.0 110.61 -165.599 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 22.0 pt -62.59 169.4 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 124.402 1.081 . . . . 0.0 111.697 169.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 61.7 mmtt 69.13 -19.99 0.17 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 126.574 1.949 . . . . 0.0 115.95 176.293 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 17.1 ptp -124.44 6.99 8.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.437 1.495 . . . . 0.0 113.79 -175.699 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -146.89 -30.51 0.35 Allowed 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 125.27 1.428 . . . . 0.0 113.331 -167.588 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -124.0 160.69 27.07 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 126.148 1.779 . . . . 0.0 112.41 -179.837 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -140.54 151.17 44.54 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.339 1.456 . . . . 0.0 111.969 -173.281 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -132.18 142.23 49.37 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.528 1.531 . . . . 0.0 111.754 -179.295 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 43.1 t -128.45 -48.15 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.714 1.205 . . . . 0.0 111.637 -179.296 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.9 m -120.5 17.38 12.11 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.293 1.437 . . . . 0.0 113.223 -177.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.5 t 62.47 152.95 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 127.273 2.229 . . . . 0.0 114.67 -166.065 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -149.81 128.0 12.04 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.23 1.412 . . . . 0.0 111.051 176.399 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 69.9 m -146.45 159.23 43.67 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.806 1.642 . . . . 0.0 111.072 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.4 34.08 0.31 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.532 1.533 . . . . 0.0 113.455 178.629 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 58.67 161.56 0.09 OUTLIER Pre-proline 0 CA--C 1.551 0.986 0 C-N-CA 129.026 2.93 . . . . 0.0 115.004 -171.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -64.61 108.93 1.13 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 122.746 2.297 . . . . 0.0 110.988 175.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -130.7 45.84 2.75 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.052 1.741 . . . . 0.0 110.422 -174.331 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 96.9 mt -118.79 150.85 49.22 Favored Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.177 1.791 . . . . 0.0 111.761 -174.375 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo . . . . . 0 C--O 1.254 1.303 0 C-N-CA 124.057 3.172 . . . . 0.0 113.417 179.371 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.541 0 N-CA-C 112.054 -0.418 . . . . 0.0 112.054 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 49.5 m -86.3 138.87 31.5 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.47 1.108 . . . . 0.0 112.139 179.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -149.31 114.62 5.51 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.533 1.133 . . . . 0.0 110.386 178.791 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 86.5 mmm -135.4 93.22 2.94 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.253 1.421 . . . . 0.0 109.942 -178.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -144.92 -73.59 0.25 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.534 1.134 . . . . 0.0 112.315 -178.598 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 54.97 20.92 3.4 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 115.978 1.844 . . . . 0.0 115.978 179.107 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? -144.29 -12.1 0.62 Allowed 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 177.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -111.42 -8.33 14.3 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.959 1.304 . . . . 0.0 114.149 -178.822 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -108.71 -10.61 15.15 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -173.772 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 7.1 mp -75.32 138.74 42.0 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.327 0.651 . . . . 0.0 111.362 -171.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -140.5 -3.45 1.32 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.498 1.119 . . . . 0.0 113.918 -179.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -98.33 89.04 4.32 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.186 1.395 . . . . 0.0 110.62 177.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.2 mp -132.05 124.5 53.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.306 1.442 . . . . 0.0 109.024 177.235 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.2 mt -136.09 49.67 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 C-N-CA 125.187 1.395 . . . . 0.0 110.061 -176.565 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -136.33 155.05 50.61 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.456 1.502 . . . . 0.0 111.67 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.89 29.07 2.1 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.694 1.198 . . . . 0.0 114.189 -175.403 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.2 pt -131.52 123.41 52.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 125.894 1.678 . . . . 0.0 110.79 -179.153 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -125.17 -97.4 0.43 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.639 1.576 . . . . 0.0 110.477 179.785 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 ttmm -150.71 63.68 0.93 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 126.139 1.776 . . . . 0.0 110.502 179.314 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -81.7 53.32 2.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.934 1.294 . . . . 0.0 113.436 -170.304 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -103.31 5.11 37.17 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -174.194 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.0 mp -106.02 -0.68 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 125.985 1.714 . . . . 0.0 112.894 -171.457 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 65.0 m-80 -96.9 7.05 47.48 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 -174.476 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 8.2 t -137.07 -23.0 1.16 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -174.095 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.5 p-10 -89.6 -13.21 37.67 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.595 1.958 . . . . 0.0 115.249 -173.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.6 t -91.98 -27.97 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.96 1.304 . . . . 0.0 112.23 -174.585 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.23 47.05 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 125.013 1.325 . . . . 0.0 111.854 -168.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 67.8 mt -135.83 129.32 32.24 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.649 1.579 . . . . 0.0 111.763 178.119 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 29.2 mmmt -136.23 16.05 3.23 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 126.131 1.773 . . . . 0.0 114.6 -174.106 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.3 t30 50.08 70.73 1.87 Allowed Pre-proline 0 CA--C 1.558 1.278 0 C-N-CA 126.527 1.931 . . . . 0.0 112.725 -176.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -77.94 74.5 5.23 Favored 'Trans proline' 0 CA--C 1.546 1.083 0 C-N-CA 124.302 3.335 . . . . 0.0 113.342 -168.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 55.9 mtm-85 -134.46 -58.96 0.82 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.61 1.564 . . . . 0.0 113.094 173.089 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.1 t -141.65 107.53 5.98 Favored Pre-proline 0 N--CA 1.476 0.863 0 C-N-CA 125.109 1.364 . . . . 0.0 109.578 -178.811 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -73.39 162.08 41.07 Favored 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 123.361 2.707 . . . . 0.0 112.008 169.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.9 t -137.1 101.81 4.66 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 124.942 1.297 . . . . 0.0 109.786 -174.667 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -131.42 18.48 4.83 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.161 1.541 . . . . 0.0 115.161 -168.19 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.5 ttpt -93.96 69.26 3.88 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.791 1.636 . . . . 0.0 111.88 -169.118 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -144.31 24.35 1.6 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.917 1.287 . . . . 0.0 113.616 -168.323 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -78.24 10.56 27.61 Favored Glycine 0 CA--C 1.541 1.701 0 O-C-N 120.315 -1.49 . . . . 0.0 115.838 -177.056 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -86.54 -0.48 56.19 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 114.843 1.423 . . . . 0.0 114.843 -168.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.7 mp -122.59 124.9 44.56 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 125.164 1.386 . . . . 0.0 110.46 179.783 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.7 m -104.74 -75.07 0.63 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 125.894 1.678 . . . . 0.0 111.648 -178.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -158.83 -40.65 0.06 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.61 -31.5 71.57 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 122.178 -0.326 . . . . 0.0 110.897 172.348 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 -71.01 -44.81 65.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.644 0.778 . . . . 0.0 112.004 -171.84 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt -71.41 -22.54 61.85 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.54 -1.35 . . . . 0.0 112.977 175.625 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -70.87 1.48 5.47 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.997 1.319 . . . . 0.0 113.973 164.814 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.7 mt -115.31 -45.34 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 126.136 1.774 . . . . 0.0 110.319 168.652 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 46.8 t -72.26 -62.3 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 120.047 1.294 . . . . 0.0 112.069 -178.613 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.36 -33.19 74.7 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.646 -0.659 . . . . 0.0 110.991 -177.183 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.29 -23.3 65.59 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 169.608 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.67 -40.73 17.06 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 119.461 1.028 . . . . 0.0 111.216 172.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -56.61 -35.44 45.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 O-C-N 120.995 -1.065 . . . . 0.0 111.499 176.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 87.8 p -76.8 -5.21 47.32 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 115.41 1.633 . . . . 0.0 115.41 174.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -98.76 -54.17 3.08 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.331 1.423 . . . . 0.0 112.055 177.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -115.58 -16.36 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -166.109 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.65 -78.88 0.36 Allowed Glycine 0 N--CA 1.467 0.717 0 C-N-CA 125.494 1.521 . . . . 0.0 111.579 167.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.2 tt -165.94 -45.24 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.842 1.257 . . . . 0.0 112.141 174.148 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -97.33 -14.9 21.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.208 1.803 . . . . 0.0 114.381 -172.796 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 -87.68 -15.62 36.65 Favored 'General case' 0 CA--C 1.545 0.756 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -171.683 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.5 pp -67.69 165.35 17.37 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.914 1.285 . . . . 0.0 112.115 165.023 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.6 p30 -119.35 169.46 9.98 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.466 1.127 . . . . 0.0 112.043 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -80.2 -26.5 39.18 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.667 1.187 . . . . 0.0 112.819 -178.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.2 m -63.71 -51.58 64.38 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.953 1.301 . . . . 0.0 111.275 -179.161 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -62.89 -39.03 93.24 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.528 0.731 . . . . 0.0 111.587 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.4 tp -62.33 -46.03 90.52 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.294 0.637 . . . . 0.0 111.608 174.289 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 27.4 p -62.04 -25.81 67.89 Favored 'General case' 0 N--CA 1.473 0.691 0 O-C-N 120.984 -1.073 . . . . 0.0 113.685 177.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -84.27 -39.05 19.72 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 125.487 1.515 . . . . 0.0 112.021 -177.187 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -91.16 -38.68 12.58 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.259 1.024 . . . . 0.0 113.348 -179.762 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.01 -19.88 42.99 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.561 1.144 . . . . 0.0 113.072 177.976 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.2 t30 61.76 69.33 0.65 Allowed 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.876 1.67 . . . . 0.0 112.143 -177.49 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 11.5 pt -137.42 168.39 21.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 126.734 2.013 . . . . 0.0 111.467 179.063 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 84.7 m -60.81 139.21 58.01 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.413 1.485 . . . . 0.0 110.147 162.496 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 19.2 t -61.12 -35.29 64.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 O-C-N 121.28 -0.887 . . . . 0.0 111.511 -179.787 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -70.79 -30.01 66.36 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.095 -1.003 . . . . 0.0 113.377 177.551 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 54.6 mttp -64.47 -40.05 94.96 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.82 167.971 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.07 -48.42 73.83 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.194 0.906 . . . . 0.0 110.962 177.254 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 mtpp -56.1 -40.84 74.29 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.797 1.239 . . . . 0.0 112.476 179.474 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.7 t -88.4 -33.68 17.81 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 -179.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -63.19 -38.31 90.69 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.237 1.015 . . . . 0.0 112.359 177.48 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 34.5 mt -48.92 -52.54 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.216 1.006 . . . . 0.0 110.651 175.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 63.0 pttt -80.85 -32.33 35.09 Favored 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.514 1.301 . . . . 0.0 114.514 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.8 m-80 -75.6 -26.73 58.11 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.882 1.219 . . . . 0.0 113.179 -179.024 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.5 t -88.54 -40.92 13.04 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 124.444 1.098 . . . . 0.0 112.626 174.656 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -149.64 75.65 1.27 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.296 1.038 . . . . 0.0 113.054 -177.198 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -62.3 -54.08 45.75 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 121.205 -0.935 . . . . 0.0 113.317 -179.367 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 25.2 ptm -161.74 12.31 0.08 Allowed 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.704 1.602 . . . . 0.0 113.496 -176.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -96.16 30.88 7.96 Favored Glycine 0 N--CA 1.471 1.003 0 O-C-N 120.919 -1.113 . . . . 0.0 114.436 -164.905 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 26.0 mmm-85 47.95 49.52 16.92 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 125.634 1.574 . . . . 0.0 112.025 -175.683 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 53.21 18.58 1.26 Allowed 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.128 1.771 . . . . 0.0 115.09 -176.498 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.8 m120 48.45 32.36 3.29 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.887 1.675 . . . . 0.0 113.436 -167.327 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -106.29 -5.38 19.17 Favored 'General case' 0 CA--C 1.553 1.083 0 C-N-CA 125.254 1.422 . . . . 0.0 114.478 -179.464 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -75.45 13.82 0.7 Allowed 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 126.512 1.925 . . . . 0.0 115.526 -168.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt -91.47 11.85 22.65 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.685 1.994 . . . . 0.0 113.752 -163.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.6 m -150.94 -47.84 0.12 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 128.658 2.783 . . . . 0.0 108.604 -169.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -73.99 156.08 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.739 0 C-N-CA 124.224 1.01 . . . . 0.0 109.454 179.371 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.47 -7.11 0.57 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 127.411 2.284 . . . . 0.0 116.438 -178.683 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 37.2 mtm -96.91 -50.59 4.58 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 119.946 1.248 . . . . 0.0 113.678 -174.705 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 25.3 p90 -91.41 -7.67 50.05 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -176.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -83.63 6.68 19.93 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.221 1.408 . . . . 0.0 114.247 -168.699 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -122.13 129.72 52.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.283 1.833 . . . . 0.0 111.46 179.032 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -152.29 156.9 40.57 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.951 1.3 . . . . 0.0 111.119 174.361 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 40.5 t -139.5 -39.28 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 125.206 1.402 . . . . 0.0 111.875 -176.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 33.2 m -127.13 22.0 6.69 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.15 1.38 . . . . 0.0 113.191 -173.507 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.9 t 57.86 58.87 3.42 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.878 1.671 . . . . 0.0 112.811 -174.528 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.53 164.47 25.79 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.029 1.332 . . . . 0.0 113.708 -179.543 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 83.7 p -110.49 170.41 8.1 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.566 1.547 . . . . 0.0 112.798 177.784 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -80.18 21.09 0.61 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.158 1.383 . . . . 0.0 114.186 178.231 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 50.93 71.55 1.5 Allowed Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 127.042 2.137 . . . . 0.0 113.105 -179.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -70.77 87.2 0.69 Allowed 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.531 3.488 . . . . 0.0 112.372 -174.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -136.77 33.71 2.67 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 126.128 1.771 . . . . 0.0 111.883 -179.63 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 93.2 mt -98.21 146.18 31.1 Favored Pre-proline 0 CA--C 1.548 0.886 0 C-N-CA 125.507 1.523 . . . . 0.0 111.866 -179.08 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo . . . . . 0 C--O 1.253 1.236 0 C-N-CA 124.05 3.167 . . . . 0.0 113.311 178.792 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.592 0 N-CA-C 111.686 -0.566 . . . . 0.0 111.686 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 53.5 m -133.84 161.7 34.03 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.624 1.57 . . . . 0.0 112.066 -177.319 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -112.36 140.74 46.83 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.084 1.353 . . . . 0.0 111.51 177.258 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 24.3 ttt -137.04 63.31 1.57 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.278 1.431 . . . . 0.0 111.937 -167.716 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -147.46 92.47 2.1 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.701 1.2 . . . . 0.0 110.717 173.239 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 17.9 m -138.93 7.78 2.49 Favored 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 -165.392 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.2 mtm -138.6 -7.66 1.47 Allowed 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 116.106 1.891 . . . . 0.0 116.106 -168.114 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -132.56 12.96 4.51 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 125.242 1.417 . . . . 0.0 112.164 -178.073 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -145.03 12.09 1.39 Allowed 'General case' 0 CA--C 1.554 1.105 0 N-CA-C 113.916 1.08 . . . . 0.0 113.916 -160.048 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 5.2 mp -130.69 64.26 1.56 Allowed 'General case' 0 N--CA 1.476 0.852 0 O-C-N 120.589 -1.32 . . . . 0.0 111.201 -174.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -133.31 11.66 4.17 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 124.976 1.31 . . . . 0.0 113.855 -171.187 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -131.53 19.2 4.75 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.476 1.51 . . . . 0.0 114.211 -169.128 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 56.6 mt -87.34 68.93 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 125.441 1.496 . . . . 0.0 110.111 -167.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 20.9 tt -152.46 72.58 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.956 1.303 . . . . 0.0 112.212 -173.642 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -128.57 32.18 4.87 Favored 'General case' 0 CA--C 1.552 1.055 0 O-C-N 120.728 -1.232 . . . . 0.0 113.363 -174.183 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -143.35 -63.55 0.4 Allowed 'General case' 0 N--CA 1.475 0.803 0 O-C-N 120.827 -1.17 . . . . 0.0 113.143 -179.389 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 10.4 pt -125.81 111.49 27.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 125.969 1.707 . . . . 0.0 109.729 -176.665 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.1 pm0 -154.15 166.82 31.88 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.926 1.691 . . . . 0.0 112.102 -172.665 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -79.75 39.54 0.42 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 126.673 1.989 . . . . 0.0 113.613 -171.62 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -88.62 117.88 27.89 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.929 1.291 . . . . 0.0 111.086 175.874 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -142.87 -73.31 0.29 Allowed 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.67 1.188 . . . . 0.0 111.658 168.115 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 59.2 mt -123.42 -8.23 7.68 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.894 1.278 . . . . 0.0 113.771 -173.732 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -68.04 -23.27 64.96 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.311 -0.868 . . . . 0.0 112.764 -173.896 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 16.4 m -82.65 -17.97 42.72 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.076 1.35 . . . . 0.0 114.354 -173.34 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -109.98 -14.07 14.31 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 179.274 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 74.2 t -84.37 -38.54 13.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.387 1.075 . . . . 0.0 111.178 177.02 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.2 t -101.76 77.49 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.752 1.221 . . . . 0.0 109.797 -177.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.1 mt -131.82 145.02 51.33 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.806 1.642 . . . . 0.0 111.544 178.471 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -129.13 37.7 4.01 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 126.028 1.731 . . . . 0.0 112.595 -178.534 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.0 t30 49.94 66.04 6.12 Favored Pre-proline 0 CA--C 1.557 1.239 0 C-N-CA 126.788 2.035 . . . . 0.0 113.674 -179.824 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -77.05 67.27 7.62 Favored 'Trans proline' 0 CA--C 1.546 1.098 0 C-N-CA 124.493 3.462 . . . . 0.0 112.497 -176.394 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 -133.84 -58.84 0.86 Allowed 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.273 1.829 . . . . 0.0 112.576 -178.319 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 44.4 t -137.63 97.75 10.14 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 125.145 1.378 . . . . 0.0 109.902 -175.614 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -76.99 170.39 19.88 Favored 'Trans proline' 0 CA--C 1.537 0.644 0 C-N-CA 123.297 2.664 . . . . 0.0 113.045 173.656 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 8.4 p -128.39 71.25 1.38 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.43 1.492 . . . . 0.0 112.343 -163.123 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -107.03 22.62 15.7 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.351 1.241 . . . . 0.0 114.351 -170.329 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.73 26.25 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 128.193 2.597 . . . . 0.0 115.452 -178.691 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.7 t -146.39 11.66 1.16 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.138 1.375 . . . . 0.0 114.161 -163.548 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.7 74.52 0.07 OUTLIER Glycine 0 CA--C 1.531 1.055 0 O-C-N 120.43 -1.419 . . . . 0.0 112.469 -177.272 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -121.08 21.46 11.27 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.011 1.324 . . . . 0.0 113.776 -165.214 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.2 mp 58.99 103.32 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 128.395 2.678 . . . . 0.0 113.894 -176.281 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 24.0 m -82.73 -71.37 0.5 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.996 0.918 . . . . 0.0 112.726 -175.536 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -163.57 -35.03 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -176.101 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -78.26 -29.22 47.97 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.74 0.416 . . . . 0.0 111.095 170.906 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -77.62 -42.64 34.21 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.569 1.548 . . . . 0.0 112.045 -168.576 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 ptpt -68.73 -26.14 65.11 Favored 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.228 -0.92 . . . . 0.0 113.035 173.752 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -68.9 -1.09 6.46 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 114.278 1.214 . . . . 0.0 114.278 168.164 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 10.3 mt -113.86 -45.23 4.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 125.414 1.486 . . . . 0.0 110.209 172.078 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 36.4 t -73.55 -64.16 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 CA-C-N 119.459 1.027 . . . . 0.0 112.01 179.07 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.01 -27.42 65.66 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.786 -0.571 . . . . 0.0 112.377 -174.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -56.67 -42.36 78.89 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 165.699 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.35 -36.45 81.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.905 0.882 . . . . 0.0 111.736 175.557 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.4 mm -62.84 -22.11 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 O-C-N 120.861 -1.149 . . . . 0.0 111.429 175.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.8 t -83.79 -11.16 57.47 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 171.905 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -96.93 -60.03 1.68 Allowed 'General case' 0 N--CA 1.474 0.736 0 O-C-N 120.522 -1.361 . . . . 0.0 112.099 -175.835 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.1 m -113.46 -17.47 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 N-CA-C 114.922 1.452 . . . . 0.0 114.922 -164.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 136.47 -83.87 0.26 Allowed Glycine 0 N--CA 1.465 0.632 0 C-N-CA 125.349 1.452 . . . . 0.0 111.171 167.615 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 tt -161.3 -46.7 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.58 1.152 . . . . 0.0 112.333 178.718 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -96.97 -20.31 18.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.189 1.796 . . . . 0.0 114.472 -174.765 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 51.0 m-80 -84.65 -11.26 56.29 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 -167.627 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.1 pp -68.31 163.03 23.9 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.178 1.791 . . . . 0.0 114.417 176.4 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -87.75 -172.41 3.85 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 125.77 1.628 . . . . 0.0 109.991 174.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -120.82 -19.22 7.4 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.038 1.335 . . . . 0.0 112.964 167.379 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.9 m -72.26 -53.41 12.57 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.401 1.08 . . . . 0.0 112.286 -173.415 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -68.2 -25.03 65.02 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 120.75 -1.219 . . . . 0.0 113.673 179.764 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.28 -58.89 4.36 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.517 0.727 . . . . 0.0 111.101 166.566 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.5 p -61.1 -25.62 67.09 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -177.121 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.7 mttt -69.06 -41.16 77.97 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.567 1.547 . . . . 0.0 113.082 171.569 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 93.9 mtt-85 -89.73 -37.95 14.19 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.272 1.429 . . . . 0.0 112.879 -174.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.11 -20.33 57.74 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.103 1.361 . . . . 0.0 113.172 171.028 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 61.21 58.91 2.08 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.833 1.253 . . . . 0.0 111.398 -177.717 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 9.0 pt -123.25 174.47 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 127.069 2.147 . . . . 0.0 110.185 174.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 51.7 m -70.36 141.29 52.24 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 125.643 1.577 . . . . 0.0 109.515 166.783 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.3 t -58.58 -39.39 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 O-C-N 121.426 -0.796 . . . . 0.0 111.057 179.442 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -70.52 -28.5 64.99 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 178.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -66.34 -39.52 89.28 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.125 -0.941 . . . . 0.0 110.786 168.796 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.65 72.22 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 119.251 0.932 . . . . 0.0 110.544 176.208 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -54.87 -37.73 66.63 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.088 1.355 . . . . 0.0 113.044 -179.143 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -86.51 -41.23 14.52 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-N 118.792 0.724 . . . . 0.0 112.732 174.695 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 85.3 t80 -61.33 -34.78 75.83 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.067 -1.02 . . . . 0.0 113.066 -177.787 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 30.0 mt -46.66 -62.75 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 125.134 1.374 . . . . 0.0 110.027 171.38 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -76.32 -19.11 58.56 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -179.417 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -77.02 -30.33 55.77 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 118.832 0.742 . . . . 0.0 112.502 177.222 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -102.88 -46.35 4.71 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.146 1.378 . . . . 0.0 113.61 -177.737 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.7 91.66 3.59 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.956 1.302 . . . . 0.0 111.998 -178.416 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 15.3 ptt85 -134.37 24.68 3.8 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 125.692 1.597 . . . . 0.0 115.026 176.64 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 68.1 mtt -76.43 -38.75 55.05 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.823 0.849 . . . . 0.0 112.809 -176.131 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.31 98.53 0.7 Allowed Glycine 0 CA--C 1.527 0.842 0 C-N-CA 125.456 1.503 . . . . 0.0 110.988 -177.403 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 1.7 mpt_? 48.8 33.64 4.56 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 125.451 1.5 . . . . 0.0 112.83 -173.308 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 50.78 31.68 6.26 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 126.618 1.967 . . . . 0.0 113.174 -175.381 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.3 m120 53.9 26.39 6.19 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 126.252 1.821 . . . . 0.0 115.049 -174.568 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.79 -8.61 40.07 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.495 1.118 . . . . 0.0 113.917 -178.514 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 p90 -70.37 7.31 1.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.931 2.092 . . . . 0.0 116.619 -168.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.66 -4.62 59.21 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.448 1.499 . . . . 0.0 114.796 -169.8 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.5 m -141.88 -46.53 0.36 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.02 1.728 . . . . 0.0 109.93 -167.147 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.3 pt -64.6 169.8 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 C-N-CA 123.637 0.775 . . . . 0.0 111.329 173.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? 69.06 -14.29 0.31 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.051 2.14 . . . . 0.0 115.5 -174.907 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.23 13.43 2.2 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 115.108 1.521 . . . . 0.0 115.108 178.339 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -146.54 38.14 1.02 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.226 1.01 . . . . 0.0 112.904 -173.334 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -145.02 153.51 41.56 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.792 1.237 . . . . 0.0 112.975 -168.05 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.6 t0 -94.21 171.3 8.92 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.514 1.526 . . . . 0.0 112.202 -178.597 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -71.59 141.35 50.03 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.902 -1.124 . . . . 0.0 112.784 176.609 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.1 t -131.21 -48.18 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 125.057 1.343 . . . . 0.0 111.33 176.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 23.4 m -119.25 15.63 13.11 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.052 1.341 . . . . 0.0 113.641 -176.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.2 t 53.99 82.69 0.08 Allowed 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 126.849 2.06 . . . . 0.0 113.738 -176.576 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -140.72 106.71 5.18 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.651 1.18 . . . . 0.0 111.442 -179.657 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 74.9 m -142.31 116.63 9.56 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 125.23 1.412 . . . . 0.0 111.138 -178.568 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 53.61 28.48 7.97 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.527 1.531 . . . . 0.0 114.796 -178.285 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -118.98 147.84 43.39 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 126.676 1.99 . . . . 0.0 111.969 -172.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -73.27 103.57 1.64 Allowed 'Trans proline' 0 CA--C 1.54 0.807 0 C-N-CA 123.331 2.687 . . . . 0.0 110.731 175.978 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -141.64 30.29 1.7 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.426 1.09 . . . . 0.0 112.731 -176.447 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 96.5 mt -126.88 87.63 56.18 Favored Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 126.164 1.785 . . . . 0.0 110.346 -175.301 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo . . . . . 0 C--O 1.252 1.217 0 C-N-CA 123.876 3.051 . . . . 0.0 113.233 179.547 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.61 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 61.6 p -127.35 149.0 50.25 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 125.528 1.531 . . . . 0.0 112.129 178.006 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -150.7 126.45 10.31 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.758 1.223 . . . . 0.0 110.502 178.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 64.5 mtt -138.88 106.62 5.63 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.676 1.191 . . . . 0.0 110.273 -178.679 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -119.9 19.39 12.4 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.273 1.429 . . . . 0.0 114.473 -175.117 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 67.0 m -119.07 17.48 13.25 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.484 1.514 . . . . 0.0 113.822 -169.639 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -150.6 -13.0 0.24 Allowed 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 116.309 1.966 . . . . 0.0 116.309 -176.606 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -133.38 13.25 4.17 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.683 1.593 . . . . 0.0 112.611 -175.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -139.4 18.12 2.56 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.398 1.879 . . . . 0.0 112.234 -171.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 68.4 mt -118.22 173.54 6.74 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.772 1.629 . . . . 0.0 111.038 -174.025 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -131.68 12.8 4.9 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.838 1.051 . . . . 0.0 113.838 -177.788 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -97.61 4.25 50.23 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -176.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.412 HD12 ' H ' ' A' ' 7' ' ' ILE . 2.9 mp -76.31 -40.26 35.41 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.212 1.005 . . . . 0.0 112.463 -167.928 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 65.5 mt -134.35 142.07 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.808 1.643 . . . . 0.0 109.961 -174.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -120.66 157.64 29.14 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.118 1.767 . . . . 0.0 111.629 177.515 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -140.71 -74.15 0.34 Allowed 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.542 1.137 . . . . 0.0 111.865 -172.453 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.4 tt -140.0 118.24 11.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 126.05 1.74 . . . . 0.0 109.461 -179.217 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -152.45 35.87 0.51 Allowed 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.259 1.424 . . . . 0.0 112.588 -169.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 52.72 35.55 18.78 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 126.353 1.861 . . . . 0.0 114.392 177.153 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 48.8 76.13 0.13 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 126.908 2.083 . . . . 0.0 114.348 -175.591 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.1 -70.41 0.44 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -175.702 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 50.9 mt -131.54 -14.15 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 125.451 1.501 . . . . 0.0 113.304 -175.856 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -71.54 -20.12 62.08 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -166.024 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.2 m -100.46 -40.3 7.53 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.888 0.875 . . . . 0.0 112.774 -176.468 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -83.14 -12.12 57.28 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.626 1.343 . . . . 0.0 114.626 -175.175 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -101.72 -30.78 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 C-N-CA 124.777 1.231 . . . . 0.0 111.795 170.441 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 20.0 t -131.36 88.67 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 124.749 1.22 . . . . 0.0 110.431 -177.367 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 9.6 tp -117.21 136.93 52.7 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.448 1.099 . . . . 0.0 111.258 173.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -127.29 28.34 5.74 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.873 1.669 . . . . 0.0 112.548 -175.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.2 t30 45.82 60.84 13.42 Favored Pre-proline 0 CA--C 1.557 1.215 0 C-N-CA 127.076 2.15 . . . . 0.0 113.324 -173.285 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -79.92 67.72 8.53 Favored 'Trans proline' 0 CA--C 1.543 0.938 0 C-N-CA 124.14 3.227 . . . . 0.0 112.611 -171.088 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -117.71 -67.62 0.98 Allowed 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.823 1.649 . . . . 0.0 112.196 -177.408 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.0 t -145.43 108.68 4.5 Favored Pre-proline 0 N--CA 1.477 0.911 0 C-N-CA 125.644 1.578 . . . . 0.0 109.498 -175.468 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -80.54 170.73 15.52 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 123.42 2.747 . . . . 0.0 113.313 175.115 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.4 p -132.79 77.8 1.76 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.863 1.665 . . . . 0.0 111.645 -163.561 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -119.59 19.27 12.64 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.511 1.671 . . . . 0.0 115.511 -171.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.6 ttpt -87.81 77.98 8.46 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.636 1.574 . . . . 0.0 111.234 -176.919 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.2 t -142.59 48.78 1.52 Allowed 'General case' 0 N--CA 1.481 1.101 0 CA-C-O 123.059 1.409 . . . . 0.0 112.576 -171.073 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 85.74 66.42 1.41 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.68 1.134 . . . . 0.0 112.975 178.413 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -89.11 14.19 11.34 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.4 1.48 . . . . 0.0 114.078 -173.059 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.9 mp -129.12 136.8 50.69 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 126.374 1.87 . . . . 0.0 110.534 178.941 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.6 p -126.46 -69.64 0.76 Allowed 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 125.667 1.587 . . . . 0.0 112.378 174.786 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -160.89 -34.31 0.05 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -167.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -76.83 -13.98 59.95 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 123.568 0.747 . . . . 0.0 111.278 172.347 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.7 mp0 -86.87 -43.65 12.29 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.097 0.862 . . . . 0.0 112.719 -177.304 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.0 mttt -64.32 -32.9 74.68 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 121.153 -0.967 . . . . 0.0 112.367 178.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -64.5 -2.79 2.52 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 115.548 1.685 . . . . 0.0 115.548 170.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 13.8 mt -112.12 -17.4 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.734 1.613 . . . . 0.0 112.276 174.443 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 17.9 t -127.68 -53.14 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 119.187 0.903 . . . . 0.0 113.373 -172.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.82 -37.89 88.54 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.778 1.172 . . . . 0.0 110.845 171.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -64.95 -28.3 69.43 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 123.992 0.917 . . . . 0.0 113.054 170.749 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -75.67 -37.84 59.24 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.307 1.043 . . . . 0.0 111.59 175.909 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.5 -33.78 55.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 O-C-N 120.937 -1.102 . . . . 0.0 110.773 170.327 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 58.3 m -72.57 -10.31 59.64 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 169.67 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -107.53 -42.72 4.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.499 1.499 . . . . 0.0 112.987 -172.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.0 m -127.99 -13.19 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -173.082 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 132.27 -83.35 0.3 Allowed Glycine 0 N--CA 1.469 0.89 0 C-N-CA 124.931 1.253 . . . . 0.0 112.223 169.092 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.8 tt -167.85 -44.5 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 126.123 1.769 . . . . 0.0 111.01 -177.504 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -107.44 -10.57 15.71 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.174 1.79 . . . . 0.0 114.913 -168.987 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -89.2 -20.34 24.31 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 113.179 0.807 . . . . 0.0 113.179 -176.39 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.15 162.82 23.97 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.638 1.175 . . . . 0.0 112.116 166.48 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -120.73 174.24 6.71 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 122.526 1.155 . . . . 0.0 112.007 174.805 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -82.1 -23.95 35.43 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.906 1.282 . . . . 0.0 112.995 179.355 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.7 m -63.36 -51.4 66.09 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 125.252 1.421 . . . . 0.0 111.131 -179.579 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -64.33 -39.07 93.16 Favored 'General case' 0 N--CA 1.474 0.737 0 O-C-N 121.41 -0.806 . . . . 0.0 112.183 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -58.33 -51.03 71.5 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.186 0.594 . . . . 0.0 111.972 168.537 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.5 p -60.14 -24.86 65.03 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.686 -1.259 . . . . 0.0 113.831 -178.529 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -87.15 -47.93 8.48 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.177 1.791 . . . . 0.0 111.922 -177.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -90.24 -29.53 18.13 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.368 1.067 . . . . 0.0 113.39 -174.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 11.2 tp -93.99 -14.57 25.77 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.759 1.624 . . . . 0.0 112.785 178.623 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 60.16 66.59 0.94 Allowed 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 126.307 1.843 . . . . 0.0 112.644 175.569 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 pt -142.94 167.56 14.13 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 127.263 2.225 . . . . 0.0 111.078 -179.059 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.407 HG22 ' H ' ' A' ' 69' ' ' ASP . 7.4 m -53.93 139.55 33.63 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.581 1.552 . . . . 0.0 110.813 164.487 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.8 t -58.31 -38.54 69.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 121.602 -0.686 . . . . 0.0 111.149 175.326 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.407 ' H ' HG22 ' A' ' 67' ' ' THR . 20.0 m-20 -72.9 -28.67 62.62 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.132 -0.98 . . . . 0.0 113.356 -179.978 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -66.57 -37.43 84.92 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 118.498 -0.763 . . . . 0.0 110.937 168.139 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.12 -47.49 73.96 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.843 0.747 . . . . 0.0 110.555 174.954 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -57.28 -38.85 74.57 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.24 1.016 . . . . 0.0 112.738 -179.544 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 3.5 t -89.6 -31.64 17.48 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -63.65 -38.04 89.61 Favored 'General case' 0 CA--C 1.536 0.419 0 O-C-N 120.585 -1.322 . . . . 0.0 112.138 176.492 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 52.9 mt -49.66 -56.67 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.143 0.977 . . . . 0.0 110.545 174.648 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -70.93 -35.76 72.37 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 113.548 0.944 . . . . 0.0 113.548 179.106 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 16.6 m-80 -66.88 -31.54 72.21 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.348 0.976 . . . . 0.0 112.965 178.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -76.9 -40.29 47.91 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.287 1.035 . . . . 0.0 112.697 175.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -147.13 87.24 1.66 Allowed 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.903 1.281 . . . . 0.0 111.592 -178.897 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 37.6 mmt180 -59.4 -42.27 91.38 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.223 1.409 . . . . 0.0 112.871 178.531 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 58.6 mtt -125.04 -36.13 2.58 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.744 1.618 . . . . 0.0 112.755 178.587 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 133.14 73.25 0.09 OUTLIER Glycine 0 N--CA 1.474 1.181 0 C-N-CA 123.423 0.535 . . . . 0.0 112.445 177.922 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 58.34 15.76 3.64 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -177.883 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 89.5 m -73.05 -10.15 59.49 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.892 0.877 . . . . 0.0 112.523 177.288 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.89 25.14 15.11 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 126.922 2.089 . . . . 0.0 113.426 165.16 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -87.96 -10.05 51.68 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.414 1.485 . . . . 0.0 113.449 -173.942 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 38.9 p90 -76.05 15.47 0.55 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.679 2.392 . . . . 0.0 114.59 -176.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 32.4 pttt -83.34 -6.71 59.55 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 128.22 2.608 . . . . 0.0 114.191 -171.14 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 44.3 m -143.16 -54.54 0.39 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 126.586 1.955 . . . . 0.0 109.806 -172.486 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 35.5 pt -71.98 164.74 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 124.038 0.935 . . . . 0.0 111.91 177.81 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 -4.41 0.48 Allowed 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 115.925 1.824 . . . . 0.0 115.925 -178.617 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 44.3 mtm -97.83 -49.49 4.79 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-N 119.764 1.166 . . . . 0.0 113.627 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -107.26 -7.29 16.8 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -175.408 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -90.91 128.05 36.62 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.127 1.371 . . . . 0.0 111.568 -174.1 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -143.52 125.9 15.71 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.823 1.249 . . . . 0.0 110.817 174.224 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -145.74 147.93 32.44 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.145 1.778 . . . . 0.0 110.506 175.616 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 45.4 t -130.62 -45.01 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 124.189 0.996 . . . . 0.0 112.057 -179.33 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.0 p -119.83 7.61 11.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.341 1.456 . . . . 0.0 114.073 -176.166 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 t -137.12 24.24 3.01 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 114.589 1.329 . . . . 0.0 114.589 -168.733 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -102.61 133.74 47.11 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.642 1.177 . . . . 0.0 111.793 175.547 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 46.0 t -155.28 173.5 16.54 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 125.99 1.716 . . . . 0.0 109.697 176.358 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -63.73 -25.61 68.27 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.451 -0.78 . . . . 0.0 112.645 164.587 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.83 81.64 6.3 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.655 1.982 . . . . 0.0 112.961 175.527 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -79.83 50.11 3.41 Favored 'Trans proline' 0 CA--C 1.548 1.204 0 C-N-CA 124.576 3.517 . . . . 0.0 112.752 -176.76 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -117.88 65.42 0.75 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.467 1.907 . . . . 0.0 111.173 -169.064 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.5 tp -133.78 100.58 13.32 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.975 1.31 . . . . 0.0 110.677 -178.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo . . . . . 0 C--O 1.253 1.235 0 C-N-CA 123.789 2.992 . . . . 0.0 113.328 -179.407 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 63.1 m -127.57 153.05 46.85 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 125.384 1.474 . . . . 0.0 111.81 179.682 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 64.2 t60 -149.12 139.18 22.12 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.505 1.122 . . . . 0.0 111.651 -179.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 66.3 mtt -136.4 95.31 3.15 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.088 1.355 . . . . 0.0 110.589 178.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -156.05 105.77 2.37 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.188 1.395 . . . . 0.0 110.235 175.035 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 5.5 t -116.41 -10.66 11.28 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 179.782 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 mmt -128.56 -7.94 5.15 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -169.381 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -113.68 6.44 16.88 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.068 1.747 . . . . 0.0 111.715 172.626 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.59 44.82 0.94 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.106 1.362 . . . . 0.0 111.94 -161.981 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.1 mp -132.24 111.03 11.04 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.589 1.556 . . . . 0.0 110.049 177.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -148.98 14.9 0.92 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.684 1.193 . . . . 0.0 113.157 -176.083 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -86.64 6.99 28.35 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.666 1.587 . . . . 0.0 114.388 -176.706 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -83.94 132.55 31.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 C-N-CA 125.285 1.434 . . . . 0.0 111.458 -169.677 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 5.3 mp -89.73 -41.7 13.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.674 1.19 . . . . 0.0 111.412 179.425 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -138.92 134.7 33.56 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.505 1.522 . . . . 0.0 110.618 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -134.14 -62.59 0.75 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.68 0.792 . . . . 0.0 112.733 -178.123 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 39.1 pt -134.03 15.11 1.3 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.831 1.653 . . . . 0.0 113.387 -176.748 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.7 pm0 -140.59 160.05 40.87 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.344 1.458 . . . . 0.0 112.482 -166.982 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -89.33 18.48 5.16 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.908 1.683 . . . . 0.0 113.838 176.669 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 58.87 122.91 0.01 OUTLIER 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 127.78 2.432 . . . . 0.0 114.574 -166.72 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -110.74 -84.8 0.56 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.957 0.903 . . . . 0.0 112.142 175.435 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 77.9 mt -121.53 -12.93 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -168.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -74.74 -15.91 60.75 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -174.425 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 t -92.13 -53.74 4.12 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.6 1.16 . . . . 0.0 112.104 -174.673 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -66.9 -15.95 63.99 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 114.365 1.246 . . . . 0.0 114.365 -176.481 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.7 p -95.69 -8.55 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 125.848 1.659 . . . . 0.0 112.968 179.508 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 11.5 t -131.24 73.85 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 125.82 1.648 . . . . 0.0 109.738 178.657 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 17.4 mt -121.66 121.24 36.92 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.305 1.442 . . . . 0.0 111.598 -178.443 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -139.24 54.48 1.71 Allowed 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.611 1.964 . . . . 0.0 111.544 178.151 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 t30 47.49 72.28 1.32 Allowed Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 126.999 2.12 . . . . 0.0 113.469 -177.048 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -76.74 74.97 4.65 Favored 'Trans proline' 0 CA--C 1.545 1.065 0 C-N-CA 124.109 3.206 . . . . 0.0 112.393 -174.346 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 80.5 mtt85 -121.04 -56.31 1.93 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.304 1.442 . . . . 0.0 113.152 179.058 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 4.1 t -137.29 65.51 50.04 Favored Pre-proline 0 N--CA 1.483 1.213 0 C-N-CA 124.283 1.033 . . . . 0.0 111.703 -177.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.03 156.59 47.38 Favored 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.429 2.086 . . . . 0.0 112.796 174.151 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.6 p -78.19 59.82 2.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 127.685 2.394 . . . . 0.0 113.522 -176.059 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -79.65 27.83 0.28 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.344 1.857 . . . . 0.0 115.834 -171.867 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -85.65 57.81 4.68 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 127.664 2.386 . . . . 0.0 112.481 -171.845 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.5 t -148.68 16.22 0.99 Allowed 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 114.511 1.3 . . . . 0.0 114.511 -163.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -163.77 -69.72 0.02 OUTLIER Glycine 0 N--CA 1.474 1.183 0 O-C-N 120.346 -1.471 . . . . 0.0 113.498 178.948 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 62.18 18.48 10.13 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 115.864 1.802 . . . . 0.0 115.864 175.251 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.7 mp -136.11 129.78 32.35 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.036 1.334 . . . . 0.0 110.589 168.171 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 48.6 m -116.7 -70.21 0.81 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 126.308 1.843 . . . . 0.0 112.68 -175.182 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -161.82 -41.21 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -171.682 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -73.1 -27.6 61.8 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.266 0.627 . . . . 0.0 110.866 174.198 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 21.3 mp0 -72.91 -33.93 66.29 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.872 1.269 . . . . 0.0 110.803 -176.087 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.1 mttt -70.21 -34.5 72.98 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.879 0.871 . . . . 0.0 112.296 170.509 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -65.46 -3.73 4.77 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 171.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.2 mt -107.85 -53.89 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 125.772 1.629 . . . . 0.0 110.124 167.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 88.8 t -73.21 -62.85 1.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 C-N-CA 124.194 0.998 . . . . 0.0 112.148 -174.431 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.13 -27.93 66.88 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.593 0.757 . . . . 0.0 111.903 -177.113 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -57.12 -44.8 83.65 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 122.792 0.437 . . . . 0.0 111.945 164.738 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.03 -38.11 89.87 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.343 1.057 . . . . 0.0 112.47 174.806 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -62.6 -19.4 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.941 0.897 . . . . 0.0 111.632 176.182 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.2 t -88.18 -13.07 42.08 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.98 1.312 . . . . 0.0 114.26 172.305 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -96.82 -55.57 2.84 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 120.544 -1.348 . . . . 0.0 112.207 -175.14 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.9 m -118.64 -18.11 6.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -167.551 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.23 -85.79 0.32 Allowed Glycine 0 CA--C 1.524 0.628 0 C-N-CA 125.775 1.655 . . . . 0.0 111.049 169.664 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 79' ' ' ASN . 45.5 tp -167.04 -36.6 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.947 1.299 . . . . 0.0 112.919 -177.706 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -104.53 -9.43 18.34 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 125.01 1.324 . . . . 0.0 114.035 -173.996 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 m-80 -97.23 -14.74 21.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.568 1.147 . . . . 0.0 113.412 -175.82 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.2 pp -70.59 164.33 25.09 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.071 1.348 . . . . 0.0 111.942 170.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -121.9 167.72 12.72 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 122.294 1.045 . . . . 0.0 112.114 174.182 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.08 -25.52 43.07 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.397 1.079 . . . . 0.0 112.668 -178.421 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.7 m -64.41 -45.49 87.35 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 125.67 1.588 . . . . 0.0 112.208 -179.113 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -65.52 -36.93 85.27 Favored 'General case' 0 N--CA 1.471 0.605 0 O-C-N 120.611 -1.305 . . . . 0.0 112.231 176.826 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.3 mp -64.27 -49.24 72.62 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.4 0.68 . . . . 0.0 111.818 172.35 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 94.3 p -64.98 -25.69 67.97 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.046 0.938 . . . . 0.0 113.312 -179.083 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -76.11 -35.61 59.22 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.159 1.384 . . . . 0.0 112.712 177.11 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 46.6 mmm-85 -100.13 -32.77 10.75 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.981 1.312 . . . . 0.0 113.452 -172.397 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.3 mt -86.8 -19.31 29.22 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.103 1.361 . . . . 0.0 112.829 173.194 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.63 57.73 3.13 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.277 1.431 . . . . 0.0 112.072 -176.09 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.8 pt -120.28 167.4 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 127.747 2.419 . . . . 0.0 109.928 175.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 13.2 t -70.91 151.42 44.73 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.392 -0.817 . . . . 0.0 110.747 165.679 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 t -58.89 -35.79 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.006 0.922 . . . . 0.0 111.262 -177.41 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -67.46 -32.63 73.62 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 179.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -68.77 -35.29 76.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 118.58 -0.724 . . . . 0.0 111.206 171.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.25 -47.39 67.9 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.809 0.731 . . . . 0.0 110.636 175.726 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -57.04 -41.96 79.62 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.231 1.412 . . . . 0.0 112.831 179.249 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.4 t -83.86 -34.08 24.68 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 179.173 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -65.71 -36.19 82.9 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 120.972 -1.08 . . . . 0.0 112.32 176.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 47.7 mt -51.13 -60.44 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 124.098 0.959 . . . . 0.0 109.841 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -54.14 -26.9 30.14 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 127.472 2.309 . . . . 0.0 115.802 174.422 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -78.21 -13.33 59.9 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 176.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.5 t -99.66 -42.42 6.88 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.648 1.179 . . . . 0.0 111.652 160.307 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.432 ' HB2' HD11 ' A' ' 52' ' ' LEU . 46.1 t30 -79.78 79.53 6.27 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 127.221 2.209 . . . . 0.0 112.426 178.761 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.7 tpp85 -122.21 1.95 9.74 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 113.935 1.087 . . . . 0.0 113.935 -179.506 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 95.7 mmm -121.47 52.78 1.21 Allowed 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.826 1.25 . . . . 0.0 111.542 -164.446 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -174.74 -125.1 0.84 Allowed Glycine 0 CA--C 1.526 0.752 0 C-N-CA 125.484 1.516 . . . . 0.0 109.962 -179.98 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 92.7 mtm-85 -72.91 2.92 5.93 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 115.48 1.659 . . . . 0.0 115.48 -176.156 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 6.6 m -72.5 11.41 0.62 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 125.504 1.522 . . . . 0.0 113.775 173.437 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 65.54 37.13 6.17 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 128.038 2.535 . . . . 0.0 111.868 166.002 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -78.29 -19.43 53.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.398 1.879 . . . . 0.0 114.942 -177.694 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -110.95 20.34 17.6 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.787 1.235 . . . . 0.0 112.78 -150.715 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -86.66 9.05 19.88 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 128.211 2.605 . . . . 0.0 114.721 -173.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 59.9 m -146.38 -49.32 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.439 1.895 . . . . 0.0 109.699 -169.327 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.6 mt -80.86 155.38 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 125.411 1.485 . . . . 0.0 109.417 179.483 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? 64.04 14.19 8.3 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 126.011 1.724 . . . . 0.0 115.316 -178.6 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 20.9 mtm -115.48 -21.34 9.83 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 -178.048 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -129.27 -6.1 4.84 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.696 1.369 . . . . 0.0 114.696 -174.98 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -94.49 18.51 11.18 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.218 1.407 . . . . 0.0 113.018 -174.142 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -88.03 16.09 6.5 Favored 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 125.86 1.664 . . . . 0.0 114.852 -168.306 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -130.12 142.95 50.55 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.061 1.744 . . . . 0.0 111.388 176.446 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.0 t -127.91 -47.87 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 124.62 1.168 . . . . 0.0 111.737 -176.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 22.8 m -119.44 14.72 12.87 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.84 1.256 . . . . 0.0 113.576 -176.791 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 t -138.6 18.62 2.71 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.375 1.47 . . . . 0.0 114.02 -175.33 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.8 156.65 19.3 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.837 1.255 . . . . 0.0 112.568 177.322 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.4 m -134.7 160.46 38.08 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.558 1.543 . . . . 0.0 111.368 177.965 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -78.18 24.76 0.24 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 125.422 1.489 . . . . 0.0 114.502 -177.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 38.4 mt-30 58.75 165.31 0.08 OUTLIER Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 128.651 2.781 . . . . 0.0 114.719 -174.148 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.0 67.89 5.85 Favored 'Trans proline' 0 CA--C 1.545 1.072 0 C-N-CA 123.768 2.979 . . . . 0.0 112.24 179.732 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -132.45 63.77 1.62 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 126.774 2.03 . . . . 0.0 110.39 -175.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 36.3 tp -118.39 80.32 16.14 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 125.588 1.555 . . . . 0.0 110.767 -177.9 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.253 1.233 0 C-N-CA 123.959 3.106 . . . . 0.0 113.296 -179.765 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 112.031 -0.427 . . . . 0.0 112.031 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 13.5 t -147.77 154.2 40.21 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.374 1.47 . . . . 0.0 111.243 175.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -143.82 117.42 9.19 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.69 1.196 . . . . 0.0 110.621 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 96.3 mtp -138.2 74.9 1.5 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.062 1.345 . . . . 0.0 110.777 -179.522 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . 60.6 -35.16 0.08 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 128.978 2.911 . . . . 0.0 117.322 -174.716 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 59.5 p 57.31 -46.11 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.916 1 C-N-CA 132.318 4.247 . . . . 0.0 117.002 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -104.65 -2.41 25.07 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 125.79 1.636 . . . . 0.0 115.018 -172.0 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -111.97 6.81 19.63 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.397 1.479 . . . . 0.0 113.743 -179.127 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.9 pp0? -138.43 23.11 2.73 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 115.297 1.591 . . . . 0.0 115.297 -168.273 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 85.8 mt -124.14 72.36 1.17 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.666 1.586 . . . . 0.0 111.934 -176.188 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -133.05 -5.79 3.08 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 114.998 1.481 . . . . 0.0 114.998 -174.38 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -101.63 89.27 3.65 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 124.72 1.208 . . . . 0.0 111.211 -179.002 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.5 mp -130.7 96.44 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.179 1.392 . . . . 0.0 108.909 178.79 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 59.1 mt -136.77 141.16 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 125.499 1.519 . . . . 0.0 109.892 -175.62 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -133.62 59.57 1.73 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.752 1.621 . . . . 0.0 110.831 179.87 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -137.09 -73.36 0.43 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.942 1.297 . . . . 0.0 111.443 -178.518 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.0 tt -144.06 118.09 3.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 126.112 1.765 . . . . 0.0 108.982 176.834 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.0 pm0 -161.01 173.29 15.45 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.794 2.037 . . . . 0.0 109.662 -172.721 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -52.13 -29.59 22.57 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.34 1.456 . . . . 0.0 114.287 -177.004 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -104.14 20.05 19.0 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 115.32 1.6 . . . . 0.0 115.32 -177.492 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -52.9 -69.08 0.12 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.437 1.495 . . . . 0.0 114.216 176.993 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 68.7 mt -130.04 -8.45 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.753 1.221 . . . . 0.0 113.258 -171.475 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -71.58 -16.95 62.32 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 113.472 0.916 . . . . 0.0 113.472 -171.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.7 t -83.04 -45.94 13.43 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.15 0.98 . . . . 0.0 113.121 179.781 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -80.97 -17.01 51.9 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.705 1.372 . . . . 0.0 114.705 -171.351 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 74.5 t -77.01 -32.06 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 124.444 1.098 . . . . 0.0 111.859 179.603 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 6.7 t -104.78 62.06 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.082 1.353 . . . . 0.0 110.066 -176.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 16.7 tp -146.75 145.05 29.82 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.201 1.4 . . . . 0.0 111.449 -176.427 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.45 38.32 4.12 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 125.512 1.525 . . . . 0.0 113.369 -178.077 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 2.6 t30 47.12 64.19 8.9 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 126.763 2.025 . . . . 0.0 113.741 178.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -80.14 67.22 8.69 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 124.208 3.272 . . . . 0.0 113.917 -167.792 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 64.7 mtp180 -139.85 -57.66 0.56 Allowed 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.027 1.731 . . . . 0.0 112.223 173.207 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.3 p -153.66 118.35 2.76 Favored Pre-proline 0 CA--C 1.543 0.696 0 C-N-CA 125.329 1.451 . . . . 0.0 110.864 -177.771 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -89.16 172.39 4.29 Favored 'Trans proline' 0 CA--C 1.536 0.588 0 C-N-CA 123.901 3.068 . . . . 0.0 113.067 173.491 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.8 p -136.84 88.92 2.4 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.98 1.712 . . . . 0.0 111.076 -164.151 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -120.82 25.7 9.53 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.946 1.699 . . . . 0.0 114.296 -176.052 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -81.09 51.63 1.62 Allowed 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.851 1.66 . . . . 0.0 112.539 -174.418 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.7 t -139.07 8.52 2.5 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.667 1.587 . . . . 0.0 113.902 -165.883 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -69.02 -32.58 73.29 Favored Glycine 0 CA--C 1.537 1.434 0 O-C-N 120.683 -1.261 . . . . 0.0 115.285 -171.847 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -135.26 17.57 3.42 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.844 1.258 . . . . 0.0 113.303 -176.876 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp -135.87 132.64 36.83 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.556 1.543 . . . . 0.0 110.747 177.097 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 62.6 m -115.88 -68.98 0.88 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 126.162 1.785 . . . . 0.0 112.27 179.902 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -163.82 -44.06 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 123.452 0.701 . . . . 0.0 111.443 -171.004 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -68.56 -28.83 67.31 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.547 1.139 . . . . 0.0 110.264 176.222 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -72.81 -34.89 67.16 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.475 1.11 . . . . 0.0 112.062 178.667 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -70.4 -34.98 73.16 Favored 'General case' 0 N--CA 1.48 1.066 0 O-C-N 120.848 -1.158 . . . . 0.0 112.491 173.085 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -60.89 -6.32 1.76 Allowed 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 168.724 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.3 mt -108.13 -56.79 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 125.84 1.656 . . . . 0.0 110.342 169.419 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.1 t -69.18 -61.79 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 123.856 0.862 . . . . 0.0 111.373 -173.599 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.82 -30.38 70.56 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.358 0.663 . . . . 0.0 111.829 -177.097 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.06 -44.61 87.56 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 122.889 0.475 . . . . 0.0 112.197 167.681 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.83 -36.75 80.92 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.992 0.917 . . . . 0.0 112.257 175.329 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.1 mm -60.56 -28.32 42.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 O-C-N 120.772 -1.205 . . . . 0.0 110.655 175.664 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.7 t -77.14 -14.75 59.74 Favored 'General case' 0 CA--C 1.547 0.852 0 N-CA-C 114.554 1.316 . . . . 0.0 114.554 173.074 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -93.74 -54.28 3.69 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.398 -1.439 . . . . 0.0 112.115 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 15.3 m -118.63 -13.17 10.33 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -164.709 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.7 -77.31 0.4 Allowed Glycine 0 N--CA 1.469 0.896 0 C-N-CA 125.365 1.46 . . . . 0.0 112.106 166.438 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 49.9 tp -163.66 -43.5 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.321 1.449 . . . . 0.0 111.854 170.758 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 73.3 m-80 -108.96 -5.6 16.03 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 -167.606 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -89.7 -17.71 27.82 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.037 0.935 . . . . 0.0 112.993 -176.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.5 pp -63.36 164.46 9.04 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.802 1.241 . . . . 0.0 112.528 165.863 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 20.6 p30 -110.36 167.01 10.52 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 122.292 1.044 . . . . 0.0 111.466 171.423 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.04 -24.25 37.99 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.145 0.978 . . . . 0.0 112.412 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.5 m -62.39 -45.25 93.96 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 126.192 1.797 . . . . 0.0 112.519 -179.49 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -65.26 -41.82 93.88 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.639 -1.288 . . . . 0.0 111.989 176.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.52 -46.06 90.13 Favored 'General case' 0 N--CA 1.471 0.592 0 O-C-N 121.657 -0.652 . . . . 0.0 111.912 174.235 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 87.7 p -65.37 -23.47 66.98 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 121.182 -0.949 . . . . 0.0 113.402 179.366 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -80.07 -30.99 39.38 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.03 1.332 . . . . 0.0 112.389 176.253 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -102.74 -40.22 6.68 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.363 1.465 . . . . 0.0 113.072 -169.944 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.4 mp -81.03 -17.77 49.07 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.606 1.162 . . . . 0.0 113.207 170.304 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 59.92 58.24 2.83 Favored 'General case' 0 CA--C 1.547 0.861 0 CA-C-O 122.693 1.235 . . . . 0.0 111.49 -175.282 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 13.1 pt -122.79 164.56 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 128.011 2.524 . . . . 0.0 109.532 177.024 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 15.4 t -70.64 153.49 42.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 121.243 -0.91 . . . . 0.0 110.766 167.568 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -58.3 -37.69 64.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 123.869 0.868 . . . . 0.0 111.167 -177.366 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -68.62 -29.99 68.62 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 113.998 1.11 . . . . 0.0 113.998 179.396 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -67.3 -38.36 84.85 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 118.634 -0.698 . . . . 0.0 111.096 170.338 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.66 -48.12 67.56 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 118.632 0.651 . . . . 0.0 110.329 177.306 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -56.47 -32.41 64.94 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.95 1.7 . . . . 0.0 113.987 178.751 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.7 t -90.25 -42.05 11.22 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.968 0.804 . . . . 0.0 112.822 173.454 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -58.6 -35.77 72.96 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.899 -1.126 . . . . 0.0 113.333 -178.393 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.6 mt -50.37 -42.47 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 125.303 1.441 . . . . 0.0 112.25 174.231 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -94.59 -25.76 16.66 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 176.396 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -68.87 -32.67 72.5 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.819 0.736 . . . . 0.0 112.952 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.0 t -87.69 -35.02 18.2 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.463 1.105 . . . . 0.0 113.749 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -108.76 -35.17 6.47 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.297 1.221 . . . . 0.0 114.297 -170.711 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 23.2 tpt180 45.61 53.67 8.33 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 127.97 2.508 . . . . 0.0 113.326 -178.637 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 60.8 mtt 62.33 -39.57 0.15 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 128.902 2.881 . . . . 0.0 115.818 -171.726 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 178.05 37.08 0.06 OUTLIER Glycine 0 CA--C 1.53 1.014 0 C-N-CA 126.106 1.812 . . . . 0.0 112.571 176.386 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 60.2 mtt-85 48.39 70.27 0.47 Allowed 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.92 2.088 . . . . 0.0 114.604 -171.469 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 41.1 p 54.41 41.97 31.67 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-O 123.247 1.499 . . . . 0.0 113.332 163.792 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -84.58 -8.0 59.06 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.457 2.303 . . . . 0.0 112.002 -173.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.4 -17.59 59.56 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 128.389 2.676 . . . . 0.0 113.163 176.666 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -71.52 15.69 0.13 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 127.015 2.126 . . . . 0.0 115.81 -174.709 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' A' ' 88' ' ' LYS . 31.6 mtmt -66.82 100.12 0.68 Allowed 'General case' 0 N--CA 1.469 0.488 0 O-C-N 120.318 -1.489 . . . . 0.0 109.573 -176.085 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 75.79 2.58 3.72 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.385 2.674 . . . . 0.0 114.827 -176.623 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.2 mt -117.66 145.72 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 124.898 1.279 . . . . 0.0 109.993 -175.464 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp 60.52 14.27 4.75 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 125.643 1.577 . . . . 0.0 114.344 -169.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 5.7 ptm -138.01 9.69 2.8 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.984 1.713 . . . . 0.0 114.02 -178.696 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -145.69 -36.05 0.29 Allowed 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.03 1.492 . . . . 0.0 115.03 -163.099 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -76.33 146.51 38.77 Favored 'General case' 0 N--CA 1.474 0.738 0 O-C-N 121.355 -0.84 . . . . 0.0 112.9 -175.266 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -98.15 160.98 13.95 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.302 1.441 . . . . 0.0 112.535 177.124 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -71.42 137.3 48.2 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.722 0.809 . . . . 0.0 112.042 172.615 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 48.2 t -125.07 -38.25 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 125.001 1.32 . . . . 0.0 111.813 178.54 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 2.7 t -130.3 34.13 4.24 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.376 1.47 . . . . 0.0 112.273 179.818 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 81.1 p 47.85 36.08 5.55 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 127.278 2.231 . . . . 0.0 116.126 174.021 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.47 100.46 2.22 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.489 1.116 . . . . 0.0 112.091 -177.062 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.1 t -154.14 168.62 25.89 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.83 1.652 . . . . 0.0 111.394 -179.532 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.5 38.42 0.49 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 126.297 1.839 . . . . 0.0 113.395 -175.853 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 47.95 64.86 7.86 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 127.135 2.174 . . . . 0.0 113.382 -179.513 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -77.96 47.85 2.47 Favored 'Trans proline' 0 CA--C 1.545 1.048 1 C-N-CA 125.347 4.031 . . . . 0.0 113.179 -175.232 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -82.56 64.02 7.0 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 126.458 1.903 . . . . 0.0 111.81 -175.001 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 6.0 mp -116.85 74.41 6.73 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 125.723 1.609 . . . . 0.0 110.754 178.145 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.255 1.325 0 C-N-CA 123.942 3.095 . . . . 0.0 113.254 178.765 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.628 0 N-CA-C 111.551 -0.62 . . . . 0.0 111.551 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 60.5 p -139.71 163.64 32.06 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.839 1.656 . . . . 0.0 112.099 179.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 24.4 t60 -139.51 129.84 25.44 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.45 1.1 . . . . 0.0 111.531 178.254 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 95.0 mmm -129.17 106.12 8.62 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.737 1.615 . . . . 0.0 109.906 -179.93 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.68 -64.61 0.43 Allowed 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.559 1.144 . . . . 0.0 112.743 178.457 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 19.8 m 55.77 12.45 0.85 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 116.77 2.137 . . . . 0.0 116.77 177.024 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mtm -139.98 -15.69 1.0 Allowed 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -175.081 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -107.62 2.7 24.12 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.781 1.632 . . . . 0.0 112.422 173.386 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.72 55.71 0.96 Allowed 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.501 1.52 . . . . 0.0 111.253 -166.024 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -136.31 165.74 25.06 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.335 1.454 . . . . 0.0 113.182 173.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 24.0 t0 55.8 42.18 29.37 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.168 1.787 . . . . 0.0 114.213 175.683 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -119.95 15.76 12.52 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.063 1.745 . . . . 0.0 114.27 -171.347 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.8 mp -81.26 67.46 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 125.141 1.376 . . . . 0.0 111.326 -172.456 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.5 tp -140.43 -10.55 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 125.14 1.376 . . . . 0.0 113.883 -177.534 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -98.01 48.12 1.01 Allowed 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.65 -1.281 . . . . 0.0 113.828 -165.763 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -137.71 -46.57 0.54 Allowed 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 179.41 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.7 pt -132.72 113.08 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.868 1.267 . . . . 0.0 110.751 -178.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.62 -176.97 6.19 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 128.065 2.546 . . . . 0.0 109.342 -176.761 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.6 mttp -67.48 94.3 0.4 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.077 0.951 . . . . 0.0 112.43 178.813 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.91 151.09 48.67 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.586 1.954 . . . . 0.0 110.394 165.448 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -140.87 26.96 2.03 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.524 1.53 . . . . 0.0 112.835 -173.708 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.3 mt 52.54 53.91 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-O 124.413 2.054 . . . . 0.0 110.425 -168.999 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.8 p-10 -121.9 -3.84 9.14 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.637 2.775 . . . . 0.0 112.671 -169.311 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 70.1 m -119.38 -39.75 2.86 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.739 1.215 . . . . 0.0 113.515 -178.181 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.8 p-10 -77.67 -22.15 51.02 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.231 1.412 . . . . 0.0 114.379 179.81 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 74.3 t -88.09 -32.56 6.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 125.565 1.546 . . . . 0.0 111.256 174.957 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 9.4 t -90.94 61.2 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.083 1.353 . . . . 0.0 110.222 -178.469 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 55.1 mt -121.27 146.45 46.81 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 126.194 1.797 . . . . 0.0 111.743 176.052 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -123.97 48.02 1.96 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 126.538 1.935 . . . . 0.0 111.726 -175.579 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 t30 48.4 73.85 0.92 Allowed Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 126.702 2.001 . . . . 0.0 113.292 178.917 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -72.66 84.17 1.26 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 123.928 3.085 . . . . 0.0 112.771 -171.341 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 19.6 mmt180 50.15 32.67 6.2 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 126.9 2.08 . . . . 0.0 114.855 176.402 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 87.7 t 50.15 102.85 0.03 OUTLIER Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 129.027 2.931 . . . . 0.0 112.732 -170.058 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -71.13 169.32 20.9 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 122.411 2.074 . . . . 0.0 112.349 176.72 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.1 p -76.0 33.69 0.12 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 127.309 2.243 . . . . 0.0 116.294 -164.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -122.97 65.46 0.97 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.369 1.467 . . . . 0.0 112.177 -177.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.85 33.36 5.6 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 126.254 1.821 . . . . 0.0 111.879 179.076 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.6 t -145.22 13.28 1.41 Allowed 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 125.174 1.39 . . . . 0.0 113.669 -167.429 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -67.6 -38.47 90.3 Favored Glycine 0 CA--C 1.538 1.49 0 O-C-N 120.488 -1.383 . . . . 0.0 115.164 -169.362 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -148.58 3.33 0.65 Allowed 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 115.144 1.535 . . . . 0.0 115.144 -175.85 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.4 mp -105.56 112.61 25.76 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.239 1.816 . . . . 0.0 110.167 179.305 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 t -93.08 -78.41 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 125.489 1.516 . . . . 0.0 111.188 170.231 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -156.56 -46.13 0.07 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 122.971 0.508 . . . . 0.0 111.156 -172.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -65.83 -29.72 70.23 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.438 0.695 . . . . 0.0 111.683 175.542 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -73.63 -45.9 50.0 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 123.954 0.901 . . . . 0.0 111.866 -169.273 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.9 ptpt -67.12 -28.14 67.91 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.221 1.009 . . . . 0.0 112.63 169.926 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -69.74 -1.74 10.01 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 124.803 1.241 . . . . 0.0 114.087 170.045 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -106.54 -53.76 6.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 C-N-CA 125.149 1.38 . . . . 0.0 109.932 168.316 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.5 t -72.39 -59.15 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 CA-C-N 119.092 0.86 . . . . 0.0 112.066 -174.694 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -69.27 -25.87 64.48 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 118.495 0.589 . . . . 0.0 112.294 -177.41 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.18 -44.56 94.96 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.661 -0.65 . . . . 0.0 112.392 164.633 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.93 -34.31 77.68 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-N 119.053 0.842 . . . . 0.0 111.945 175.582 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 mm -61.52 -22.66 28.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 O-C-N 120.559 -1.338 . . . . 0.0 112.023 174.154 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.3 t -83.63 -12.79 55.53 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 124.557 1.143 . . . . 0.0 114.065 171.952 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -93.41 -56.37 2.96 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.635 -1.291 . . . . 0.0 112.284 -175.607 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.3 m -122.94 -17.23 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 115.365 1.617 . . . . 0.0 115.365 -165.611 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 130.45 -89.08 0.3 Allowed Glycine 0 CA--C 1.523 0.585 0 C-N-CA 125.758 1.647 . . . . 0.0 110.413 172.711 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 54.3 tp -163.72 -36.33 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.101 1.36 . . . . 0.0 113.066 177.921 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -107.68 -2.66 19.94 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 114.657 1.355 . . . . 0.0 114.657 -173.287 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -94.91 -17.84 21.66 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.241 1.016 . . . . 0.0 112.955 178.771 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -73.43 164.41 26.7 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 125.336 1.454 . . . . 0.0 111.924 169.634 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 19.9 p30 -115.39 172.61 6.99 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 122.194 0.997 . . . . 0.0 111.653 170.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.79 -21.36 29.97 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.427 1.091 . . . . 0.0 112.611 178.571 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.0 m -63.25 -50.19 71.16 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 125.892 1.677 . . . . 0.0 111.643 -178.346 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 17.3 mt-10 -66.37 -45.53 79.8 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.829 -1.169 . . . . 0.0 112.276 -179.296 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.7 mp -52.29 -54.31 32.96 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.504 1.122 . . . . 0.0 112.241 170.317 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 55.4 p -66.88 -27.99 67.96 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -177.599 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -70.8 -46.76 62.25 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 125.086 1.355 . . . . 0.0 112.637 173.324 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 66.1 mtt85 -78.46 -40.61 35.12 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.504 0.927 . . . . 0.0 113.504 -178.21 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.5 tt -85.45 -19.01 31.92 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.395 1.478 . . . . 0.0 111.747 -177.538 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 63.23 66.52 0.71 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.0 1.72 . . . . 0.0 111.92 179.069 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 8.6 pt -132.37 172.75 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 127.004 2.121 . . . . 0.0 110.956 178.907 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 55.0 m -66.05 137.72 57.28 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 125.226 1.41 . . . . 0.0 109.05 165.625 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 17.7 t -57.41 -38.97 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 O-C-N 121.716 -0.615 . . . . 0.0 110.984 -179.131 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.87 -26.53 64.24 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.815 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 40.1 mttp -66.78 -39.49 87.83 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 118.566 -0.73 . . . . 0.0 111.268 169.526 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -67.53 -45.72 74.91 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.901 0.773 . . . . 0.0 110.299 175.031 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.7 mtpt -54.79 -42.24 71.52 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.765 1.226 . . . . 0.0 112.608 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.4 t -83.4 -38.06 22.46 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 176.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -62.62 -33.75 75.63 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.067 -1.021 . . . . 0.0 113.277 -178.503 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 39.4 mt -49.13 -47.0 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.988 1.315 . . . . 0.0 111.418 172.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -87.32 -26.88 23.17 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 175.694 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -66.98 -33.16 74.97 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.192 0.906 . . . . 0.0 112.632 -179.29 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 5.7 t -93.12 -39.52 11.0 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -178.398 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -100.19 -30.14 12.08 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -173.866 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 17.5 tpt85 46.36 53.59 9.45 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 128.151 2.58 . . . . 0.0 114.128 179.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 25.9 mmt 64.53 -28.39 0.1 Allowed 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 128.122 2.569 . . . . 0.0 116.224 -176.359 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 158.06 -45.68 0.47 Allowed Glycine 0 N--CA 1.471 0.996 0 C-N-CA 124.711 1.148 . . . . 0.0 111.031 164.578 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 94.0 mtt-85 -124.57 -84.65 0.64 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 126.063 1.745 . . . . 0.0 110.319 163.647 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 72.3 p -145.51 20.6 1.52 Allowed 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -164.441 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 57.3 40.56 27.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.739 1.615 . . . . 0.0 111.616 -171.676 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -82.05 -19.07 41.04 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.536 1.535 . . . . 0.0 114.865 -174.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -116.06 10.61 15.09 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -141.824 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -85.12 -6.53 59.3 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.354 1.862 . . . . 0.0 115.02 -167.53 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 54.1 m -144.45 -46.39 0.25 Allowed 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.709 1.603 . . . . 0.0 110.993 -164.094 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.2 pt -75.93 174.37 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 125.044 1.338 . . . . 0.0 111.889 175.128 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 65.21 -15.69 0.1 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 127.18 2.192 . . . . 0.0 116.16 -175.039 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 4.0 ptm -123.85 1.13 8.7 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.708 1.603 . . . . 0.0 114.241 -176.757 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -134.2 -9.59 2.6 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 -166.13 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -104.94 94.25 5.15 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.849 1.26 . . . . 0.0 110.813 -173.76 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -150.22 159.17 44.63 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.231 1.412 . . . . 0.0 111.53 179.667 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -76.29 140.56 41.58 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.265 1.026 . . . . 0.0 112.681 178.213 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.7 t -131.25 -45.8 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.242 1.417 . . . . 0.0 111.069 176.157 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.7 m -122.79 30.95 6.23 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.695 1.598 . . . . 0.0 112.558 -179.196 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 67.9 m 47.17 56.47 6.82 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 126.918 2.087 . . . . 0.0 114.423 175.86 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.06 101.43 0.87 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.585 1.154 . . . . 0.0 111.896 -177.363 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 13.1 t -157.69 169.8 23.81 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.98 1.712 . . . . 0.0 111.129 -176.66 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -79.08 32.57 0.22 Allowed 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 126.154 1.781 . . . . 0.0 113.937 179.338 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 59.93 156.29 0.1 Allowed Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 129.533 3.133 . . . . 0.0 115.876 -175.031 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -76.89 83.91 2.02 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 123.704 2.936 . . . . 0.0 111.761 -176.234 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -126.88 32.97 5.02 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.668 1.587 . . . . 0.0 112.79 -175.391 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 1.8 tt -133.22 70.26 77.71 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 125.326 1.45 . . . . 0.0 110.576 176.452 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--O 1.254 1.287 0 C-N-CA 123.987 3.125 . . . . 0.0 113.255 179.319 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.629 0 N-CA-C 112.179 -0.368 . . . . 0.0 112.179 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 88.6 p -144.59 163.35 34.16 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.555 1.542 . . . . 0.0 112.273 179.687 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.5 t-160 -133.02 33.5 3.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.933 1.293 . . . . 0.0 112.618 -174.275 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 90.7 mtp -84.59 66.51 9.57 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.098 1.359 . . . . 0.0 111.315 -176.932 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -141.35 90.4 2.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.895 1.678 . . . . 0.0 110.833 -176.45 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.7 t -137.97 17.07 2.83 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 125.076 1.35 . . . . 0.0 114.199 -171.274 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtt -129.25 -26.87 2.52 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 115.127 1.529 . . . . 0.0 115.127 -175.969 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -109.63 -26.22 10.01 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.881 1.672 . . . . 0.0 112.414 176.094 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.48 HE21 ' CD1' ' A' ' 4' ' ' LEU . 12.8 tt0 -90.1 -43.23 10.62 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.146 1.378 . . . . 0.0 111.85 178.26 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.48 ' CD1' HE21 ' A' ' 3' ' ' GLN . 10.9 mp -99.36 133.48 43.6 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.972 1.309 . . . . 0.0 109.774 175.701 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -155.0 -52.73 0.09 Allowed 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 174.6 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -109.17 22.92 15.24 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.006 1.323 . . . . 0.0 113.416 -167.576 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 15.4 mm -84.86 60.22 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.387 1.475 . . . . 0.0 110.871 -166.337 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 25.3 mt -136.21 -42.92 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 126.302 1.841 . . . . 0.0 110.896 -175.954 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -135.57 166.82 22.34 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 125.569 1.548 . . . . 0.0 111.985 -177.76 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -131.66 163.04 29.0 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.585 1.554 . . . . 0.0 111.49 -176.746 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 29.6 pt -115.91 113.21 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 126.492 1.917 . . . . 0.0 111.41 -171.601 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.3 pm0 -147.64 31.89 0.88 Allowed 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.832 1.653 . . . . 0.0 113.682 -176.15 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 97.2 mttt 60.68 6.44 1.14 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 127.209 2.204 . . . . 0.0 116.523 -177.689 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -148.88 148.05 29.41 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.021 1.728 . . . . 0.0 110.125 172.526 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -149.92 -78.64 0.14 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.843 1.257 . . . . 0.0 111.482 179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 2.3 mp -125.9 -16.54 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.053 0 C-N-CA 125.005 1.322 . . . . 0.0 114.007 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.5 m-80 -69.12 -17.68 63.87 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -165.682 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 43.7 m -91.29 -46.4 8.07 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.36 1.064 . . . . 0.0 112.477 175.656 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -79.23 -15.17 58.43 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.349 1.24 . . . . 0.0 114.349 -175.018 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 5.8 p -76.03 -15.86 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 123.835 0.854 . . . . 0.0 112.773 175.311 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.6 t -115.48 68.23 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 125.792 1.637 . . . . 0.0 110.276 179.903 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -126.77 22.66 6.81 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.34 1.456 . . . . 0.0 113.649 -173.652 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.7 tttm -100.14 45.84 0.97 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.631 2.772 . . . . 0.0 110.986 -174.153 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 3.6 t30 49.2 61.55 13.77 Favored Pre-proline 0 CA--C 1.557 1.235 0 C-N-CA 127.434 2.294 . . . . 0.0 113.797 -176.381 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -81.91 40.73 1.01 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 124.803 3.668 . . . . 0.0 114.41 -167.547 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 47.6 ptt85 -137.7 -21.68 1.12 Allowed 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -169.026 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 16.5 t 33.94 79.6 0.28 Allowed Pre-proline 0 N--CA 1.485 1.294 0 C-N-CA 128.551 2.74 . . . . 0.0 114.292 173.127 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -70.96 170.91 16.86 Favored 'Trans proline' 0 CA--C 1.539 0.752 0 C-N-CA 123.073 2.515 . . . . 0.0 113.437 179.433 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 17.8 p -112.81 51.71 0.81 Allowed 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 126.176 1.79 . . . . 0.0 113.94 -163.16 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -77.38 29.02 0.15 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 116.037 1.865 . . . . 0.0 116.037 -178.012 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.42 66.82 8.2 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.849 2.059 . . . . 0.0 111.387 178.666 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.8 t -145.79 12.52 1.29 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 -172.055 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -87.04 -89.1 1.03 Allowed Glycine 0 CA--C 1.529 0.927 0 O-C-N 120.761 -1.212 . . . . 0.0 112.628 -176.517 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -139.11 28.67 2.29 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.775 1.23 . . . . 0.0 113.255 -168.05 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.3 mp -131.51 130.8 42.84 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.943 1.297 . . . . 0.0 111.208 176.836 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.4 t -112.86 -77.22 0.58 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 127.42 2.288 . . . . 0.0 111.544 179.53 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -155.7 -40.98 0.08 Allowed 'General case' 0 C--N 1.327 -0.41 0 O-C-N 122.105 -0.372 . . . . 0.0 111.958 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -67.7 -28.76 67.95 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.546 0.739 . . . . 0.0 111.008 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 13.6 mp0 -71.84 -32.4 67.49 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.812 -0.555 . . . . 0.0 112.35 179.574 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mttt -70.08 -34.84 73.68 Favored 'General case' 0 N--CA 1.48 1.07 0 O-C-N 120.889 -1.132 . . . . 0.0 112.779 170.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 56.6 mttm -64.46 0.48 1.04 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 169.115 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 7.8 mt -112.54 -52.2 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 126.531 1.932 . . . . 0.0 110.924 167.492 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 64.0 t -74.05 -59.97 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 CA-C-N 118.905 0.775 . . . . 0.0 112.275 -175.061 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.05 -28.78 68.49 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.536 -0.728 . . . . 0.0 111.811 -179.938 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -65.35 -11.32 40.92 Favored 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 167.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -95.04 -36.88 11.36 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.212 1.405 . . . . 0.0 111.299 167.132 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.7 mm -63.72 -27.55 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 O-C-N 120.518 -1.364 . . . . 0.0 112.027 178.915 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.0 p -68.43 -19.83 64.61 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 114.977 1.473 . . . . 0.0 114.977 168.336 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -106.96 -42.06 5.02 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.173 0.897 . . . . 0.0 113.168 -157.526 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.8 m -128.03 -14.67 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -175.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 131.76 -93.33 0.29 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 125.821 1.677 . . . . 0.0 110.173 173.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.4 pp -164.0 -28.78 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 125.636 1.574 . . . . 0.0 113.372 175.666 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p-10 -108.35 -12.91 14.98 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.258 1.823 . . . . 0.0 114.603 -172.007 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -91.89 -20.18 21.7 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.121 0.968 . . . . 0.0 112.938 -175.857 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 4.0 pp -67.87 164.0 20.7 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.637 1.575 . . . . 0.0 112.187 166.62 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.06 171.25 7.78 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.374 1.083 . . . . 0.0 111.946 172.276 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -83.95 -20.75 32.37 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.102 1.361 . . . . 0.0 113.005 -179.166 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 26.9 m -67.74 -46.99 70.55 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.835 1.654 . . . . 0.0 111.807 -178.564 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -65.8 -45.13 83.52 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.114 -0.991 . . . . 0.0 112.041 178.769 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -52.48 -56.34 15.81 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.085 0.554 . . . . 0.0 112.103 168.969 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.8 p -64.69 -21.84 66.84 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.235 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -74.03 -48.66 28.51 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.591 1.557 . . . . 0.0 112.187 173.377 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -76.11 -39.42 55.24 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.89 0.876 . . . . 0.0 112.636 179.762 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.3 mt -81.72 -21.99 37.61 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.094 1.357 . . . . 0.0 113.164 -179.125 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 59.65 58.5 2.85 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.335 1.454 . . . . 0.0 111.991 -176.764 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.4 pt -123.71 178.44 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 127.68 2.392 . . . . 0.0 109.644 175.358 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.8 t -76.59 147.88 37.34 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 121.494 -0.754 . . . . 0.0 110.843 164.438 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 21.2 t -53.76 -35.13 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 125.109 1.363 . . . . 0.0 110.982 175.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -71.25 -24.22 62.13 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 -176.205 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -78.19 -37.4 45.73 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.081 0.855 . . . . 0.0 111.253 168.934 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.28 -47.85 75.24 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.701 0.682 . . . . 0.0 110.132 -179.094 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -64.43 -30.78 71.81 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -175.448 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.9 t -89.99 -33.25 16.44 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 118.906 0.776 . . . . 0.0 112.709 174.899 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 70.1 t80 -63.09 -37.09 85.81 Favored 'General case' 0 CA--C 1.537 0.466 0 O-C-N 121.067 -1.021 . . . . 0.0 112.483 177.772 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.5 mt -50.32 -63.12 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 124.361 1.064 . . . . 0.0 110.22 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -63.63 -29.76 70.96 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.934 1.087 . . . . 0.0 113.934 -179.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 15.0 m-80 -67.38 -23.09 65.55 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.065 0.848 . . . . 0.0 112.885 174.722 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.4 t -82.91 -53.7 5.65 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.915 0.886 . . . . 0.0 111.87 167.771 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.81 91.17 3.52 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.137 1.375 . . . . 0.0 112.875 -170.707 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.98 7.96 9.29 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 126.464 1.906 . . . . 0.0 115.088 -179.385 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 77.8 mtm -79.12 -22.13 45.6 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -167.291 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 102.59 90.34 2.13 Favored Glycine 0 N--CA 1.472 1.046 0 C-N-CA 125.66 1.6 . . . . 0.0 111.101 -179.591 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 49.6 mtm-85 31.8 61.97 0.28 Allowed 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 127.384 2.274 . . . . 0.0 113.877 -171.422 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 37.6 p 52.91 19.18 1.25 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 125.873 1.669 . . . . 0.0 114.991 177.024 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 46.95 34.14 2.57 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 126.467 1.907 . . . . 0.0 113.564 -167.254 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.4 -9.01 19.76 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -177.475 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.0 p90 -71.48 14.87 0.15 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 127.074 2.149 . . . . 0.0 115.516 -172.805 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 19.3 pttt -92.23 -4.55 53.93 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.982 2.513 . . . . 0.0 115.048 -166.025 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 57.2 m -145.77 -46.12 0.21 Allowed 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 126.103 1.761 . . . . 0.0 110.475 -168.544 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 29.4 pt -64.65 167.16 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 124.57 1.148 . . . . 0.0 111.575 173.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.0 mmpt? 67.07 -9.9 0.35 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 126.496 1.919 . . . . 0.0 115.928 -176.669 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 18.8 ptt? -143.59 19.65 1.85 Allowed 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 119.659 1.118 . . . . 0.0 113.792 -176.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -152.49 -40.35 0.1 Allowed 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.424 1.089 . . . . 0.0 112.921 -176.144 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.9 mm-40 -81.12 159.9 24.57 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.847 1.259 . . . . 0.0 112.699 175.742 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -133.78 161.42 34.75 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.058 1.743 . . . . 0.0 111.745 176.573 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -122.61 153.33 39.45 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.679 1.592 . . . . 0.0 111.498 177.39 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 46.3 t -82.1 -20.7 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.886 0 C-N-CA 124.417 1.087 . . . . 0.0 112.237 -175.317 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 1.7 t 59.33 31.41 21.11 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.613 1.165 . . . . 0.0 112.447 -162.811 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 15.9 t -144.01 139.15 28.86 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.698 1.599 . . . . 0.0 111.033 173.304 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -154.18 171.69 18.78 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.922 1.689 . . . . 0.0 111.296 -175.391 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 57.4 m -124.28 177.24 5.96 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.051 1.341 . . . . 0.0 111.14 -176.795 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.12 -18.06 56.03 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 176.775 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -139.22 98.19 8.37 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 126.529 1.931 . . . . 0.0 110.264 167.654 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -74.22 121.56 6.95 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.074 2.516 . . . . 0.0 110.051 173.375 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -134.4 40.66 2.99 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.199 1.4 . . . . 0.0 112.031 -173.57 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.8 tt -120.6 89.53 44.75 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 125.774 1.63 . . . . 0.0 109.605 -177.707 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo . . . . . 0 C--O 1.254 1.276 0 C-N-CA 124.025 3.15 . . . . 0.0 113.331 -177.848 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.506 0 N-CA-C 111.161 -0.776 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 27.1 m -67.39 159.23 29.88 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.769 1.228 . . . . 0.0 113.628 -179.425 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -127.74 148.41 50.42 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.824 1.65 . . . . 0.0 111.307 173.755 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 31.7 ttm -136.92 37.33 2.59 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 125.28 1.432 . . . . 0.0 112.596 -175.145 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -124.08 -59.69 1.48 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.684 1.593 . . . . 0.0 111.777 178.035 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 56.34 17.68 3.0 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 174.997 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.2 mtp -146.9 -13.69 0.42 Allowed 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.926 1.454 . . . . 0.0 114.926 -179.456 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -114.11 4.96 15.81 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.747 1.619 . . . . 0.0 112.761 178.302 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -150.65 39.79 0.73 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 125.03 1.332 . . . . 0.0 112.285 -163.518 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 10.1 mp -109.53 127.16 54.26 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.384 1.474 . . . . 0.0 110.934 178.799 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -156.57 15.99 0.31 Allowed 'General case' 0 CA--C 1.554 1.098 0 N-CA-C 114.246 1.202 . . . . 0.0 114.246 -173.34 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -122.18 17.03 10.74 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 120.539 -1.351 . . . . 0.0 114.454 -167.841 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 82.6 mt -98.87 98.56 7.28 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 124.96 1.304 . . . . 0.0 110.034 -165.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 6.1 mt -138.87 54.32 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 C-N-CA 125.172 1.389 . . . . 0.0 110.669 -172.892 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -135.18 50.78 2.12 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 125.061 1.344 . . . . 0.0 112.29 -176.099 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.2 tt0 -144.77 130.15 18.78 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.581 1.152 . . . . 0.0 112.719 -174.402 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.3 pp -150.53 145.75 16.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 127.713 2.405 . . . . 0.0 111.079 177.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -129.59 26.68 5.31 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 126.481 1.912 . . . . 0.0 113.946 -178.846 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm 51.83 60.29 3.95 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 120.792 -1.193 . . . . 0.0 111.943 -172.496 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -57.77 107.14 0.42 Allowed 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.585 1.554 . . . . 0.0 112.844 -173.829 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -92.93 43.44 1.12 Allowed 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.158 -1.383 . . . . 0.0 113.504 -164.247 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.8 mt 52.89 40.22 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 125.687 1.595 . . . . 0.0 110.888 -168.767 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 26.4 p30 -107.82 -9.28 15.79 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 125.897 1.679 . . . . 0.0 112.808 -179.486 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 51.7 p -113.04 -51.67 2.82 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.404 1.481 . . . . 0.0 112.568 -171.953 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -66.76 -23.39 66.07 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.749 1.62 . . . . 0.0 114.813 -179.638 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 69.2 t -90.82 -25.28 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 125.544 1.538 . . . . 0.0 112.041 175.845 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 4.4 t -117.66 62.2 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 125.327 1.451 . . . . 0.0 110.371 -172.11 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.7 tp -142.43 138.69 31.25 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.759 1.224 . . . . 0.0 111.684 179.319 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 62.4 tttt -139.14 33.22 2.13 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.072 1.749 . . . . 0.0 112.946 -177.096 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.8 t30 46.41 67.29 4.51 Favored Pre-proline 0 CA--C 1.556 1.187 0 C-N-CA 126.967 2.107 . . . . 0.0 113.688 -177.601 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -77.74 45.52 1.79 Allowed 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 124.898 3.732 . . . . 0.0 114.338 -170.969 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.7 mmt85 -134.28 27.22 3.8 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 127.632 2.373 . . . . 0.0 113.64 -172.43 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 15.1 t -115.11 78.41 5.69 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 125.444 1.497 . . . . 0.0 111.415 178.086 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -80.74 165.21 20.23 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 123.817 3.011 . . . . 0.0 112.87 174.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.9 p -86.57 56.86 4.19 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 125.49 1.516 . . . . 0.0 112.048 171.11 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 56.07 31.64 18.51 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.229 1.812 . . . . 0.0 114.097 174.219 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -93.91 35.45 1.15 Allowed 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 126.066 1.747 . . . . 0.0 113.401 -171.378 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.1 t -147.03 19.52 1.25 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.534 1.133 . . . . 0.0 113.725 -165.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -71.7 -69.92 1.3 Allowed Glycine 0 CA--C 1.533 1.162 0 O-C-N 120.567 -1.333 . . . . 0.0 112.895 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -136.97 -63.4 0.61 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 125.101 1.36 . . . . 0.0 111.439 177.636 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 8.4 mp -114.19 115.46 27.51 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 127.19 2.196 . . . . 0.0 109.593 179.848 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 85.1 p -97.76 -71.4 0.69 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.641 1.176 . . . . 0.0 111.667 169.026 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -163.67 -34.31 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 124.575 1.15 . . . . 0.0 111.666 -168.354 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -78.83 -32.81 46.32 Favored 'General case' 0 CA--C 1.537 0.472 0 O-C-N 121.819 -0.55 . . . . 0.0 111.705 173.742 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.9 mp0 -75.09 -39.16 60.94 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 121.174 -0.954 . . . . 0.0 112.527 -170.077 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -67.66 -28.51 67.76 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.27 -0.894 . . . . 0.0 112.406 172.787 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -67.5 -6.88 21.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 168.476 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 8.2 mt -101.56 -39.72 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.012 1.325 . . . . 0.0 111.052 170.825 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.6 t -90.48 -54.15 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 CA-C-N 119.059 0.845 . . . . 0.0 113.141 -174.563 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.14 -35.66 81.5 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.104 0.865 . . . . 0.0 110.999 -179.919 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -59.26 -33.43 71.03 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 169.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -75.22 -38.09 60.83 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.095 -1.003 . . . . 0.0 111.767 176.442 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.1 mp -61.84 -26.99 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 O-C-N 120.858 -1.151 . . . . 0.0 111.229 173.009 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.4 m -79.51 -12.13 59.88 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 170.187 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -104.7 -39.5 6.32 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.622 1.101 . . . . 0.0 112.821 -172.462 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -132.64 -15.53 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 N-CA-C 115.024 1.491 . . . . 0.0 115.024 -171.58 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 129.37 -82.1 0.34 Allowed Glycine 0 N--CA 1.468 0.782 0 C-N-CA 125.417 1.484 . . . . 0.0 111.62 171.377 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 35.6 tp -171.66 -34.51 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.471 1.908 . . . . 0.0 111.236 177.026 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -107.69 -5.59 17.33 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 114.768 1.396 . . . . 0.0 114.768 -167.05 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -99.09 -22.46 15.68 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 2.4 pp -62.65 157.94 19.57 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.917 1.287 . . . . 0.0 112.612 171.02 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -112.56 172.67 6.78 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 122.493 1.139 . . . . 0.0 112.094 177.617 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -87.07 -18.55 30.27 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.988 1.315 . . . . 0.0 112.739 -179.058 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.7 m -66.5 -50.24 63.9 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.689 1.596 . . . . 0.0 111.417 -179.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 18.0 mt-10 -65.92 -45.37 82.14 Favored 'General case' 0 N--CA 1.476 0.829 0 O-C-N 120.964 -1.085 . . . . 0.0 111.973 179.813 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.8 mp -53.25 -52.73 58.06 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.763 0.825 . . . . 0.0 112.862 170.035 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.7 p -63.6 -28.22 69.78 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 120.738 -1.226 . . . . 0.0 113.669 -179.351 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -75.81 -44.24 42.16 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.3 1.44 . . . . 0.0 112.783 177.312 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 72.6 mmt-85 -86.89 -39.21 16.02 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.586 1.154 . . . . 0.0 113.742 -176.557 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 1.3 tt -85.06 -17.74 36.49 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.691 1.597 . . . . 0.0 111.663 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 61.66 64.14 1.07 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.978 1.711 . . . . 0.0 111.825 178.892 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 16.0 pt -132.53 162.63 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 127.547 2.339 . . . . 0.0 109.104 178.502 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.1 t -68.35 149.92 48.81 Favored 'General case' 0 N--CA 1.474 0.746 0 O-C-N 121.495 -0.753 . . . . 0.0 110.338 166.87 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.4 t -57.43 -34.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 C-N-CA 123.987 0.915 . . . . 0.0 111.078 -177.853 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -68.35 -33.12 73.71 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 178.781 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 35.3 mtmt -67.72 -35.44 78.77 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-N 118.915 0.78 . . . . 0.0 111.181 171.317 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -68.82 -48.78 62.7 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.796 0.726 . . . . 0.0 110.615 176.421 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -57.81 -32.11 67.24 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 125.564 1.546 . . . . 0.0 113.665 179.051 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 4.1 t -89.71 -43.18 10.88 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.024 0.829 . . . . 0.0 113.003 174.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -58.75 -36.95 75.18 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 119.76 1.164 . . . . 0.0 113.129 -177.988 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 50.2 mt -48.96 -48.09 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 C-N-CA 125.063 1.345 . . . . 0.0 111.731 173.884 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.6 pttm -91.66 -25.34 19.18 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.963 1.097 . . . . 0.0 113.963 179.438 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -72.44 -31.56 65.56 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 119.397 0.999 . . . . 0.0 112.38 179.493 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.2 t -84.39 -38.1 20.69 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 124.361 1.064 . . . . 0.0 113.464 177.725 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -116.22 -29.06 6.36 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 115.03 1.493 . . . . 0.0 115.03 -169.073 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.6 tpp85 46.87 42.63 12.38 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 128.345 2.658 . . . . 0.0 115.328 -177.868 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 2.5 mpt? 63.27 -35.89 0.14 Allowed 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 127.888 2.475 . . . . 0.0 115.802 -179.717 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 140.91 -66.5 0.5 Allowed Glycine 0 N--CA 1.468 0.828 0 C-N-CA 126.068 1.794 . . . . 0.0 111.329 163.729 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.2 11.44 4.2 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.652 1.581 . . . . 0.0 113.72 174.075 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 30.6 m -57.56 -43.5 84.55 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 124.011 0.924 . . . . 0.0 113.378 -175.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -153.11 28.09 0.52 Allowed 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 114.348 -1.296 . . . . 0.0 112.418 168.935 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -111.85 33.58 4.71 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.979 1.712 . . . . 0.0 111.967 -172.511 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -124.99 17.52 8.52 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.764 1.626 . . . . 0.0 113.21 -173.808 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -76.82 -6.17 51.23 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 127.107 2.163 . . . . 0.0 115.873 -175.593 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.0 t -137.17 -38.63 0.61 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 125.434 1.494 . . . . 0.0 112.137 177.146 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.1 mt -63.23 157.85 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 125.299 1.44 . . . . 0.0 109.178 167.615 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.5 -24.2 0.06 Allowed 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 127.321 2.248 . . . . 0.0 116.858 -177.29 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -101.83 -25.71 13.72 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.122 1.369 . . . . 0.0 114.439 175.894 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -87.08 -4.68 59.17 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 171.387 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -88.98 149.79 23.12 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.513 1.525 . . . . 0.0 112.077 -178.961 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -142.01 34.73 1.55 Allowed 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.562 1.145 . . . . 0.0 113.213 -171.287 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -81.73 144.31 31.22 Favored 'General case' 0 CA--C 1.543 0.679 0 O-C-N 120.746 -1.221 . . . . 0.0 112.46 177.651 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 60.1 t -130.3 -48.67 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 124.724 1.21 . . . . 0.0 111.703 -178.608 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 68.0 p -113.4 4.53 16.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.445 1.498 . . . . 0.0 114.205 -176.654 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 t -110.58 7.07 22.31 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.354 1.462 . . . . 0.0 114.507 -169.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.42 128.54 35.21 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.882 -1.136 . . . . 0.0 112.059 178.92 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 73.8 m -153.42 131.33 11.71 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 125.816 1.647 . . . . 0.0 109.616 -179.093 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 52.28 33.93 13.66 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.818 1.247 . . . . 0.0 114.243 -177.11 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -124.05 63.98 33.21 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 125.755 1.622 . . . . 0.0 113.428 178.128 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -80.03 51.05 3.74 Favored 'Trans proline' 0 CA--C 1.548 1.193 0 C-N-CA 124.496 3.464 . . . . 0.0 113.39 -179.469 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -105.97 77.46 1.25 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.407 1.483 . . . . 0.0 110.269 -179.794 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 92.0 mt -117.79 152.34 49.82 Favored Pre-proline 0 CA--C 1.549 0.926 0 C-N-CA 125.98 1.712 . . . . 0.0 111.911 178.552 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 C--O 1.253 1.253 0 C-N-CA 124.011 3.141 . . . . 0.0 113.388 178.19 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' -5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 112.026 -0.43 . . . . 0.0 112.026 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' -4' ' ' SER . . . . . . . . . . . . . 8.2 t -147.56 164.48 33.31 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.383 1.473 . . . . 0.0 111.492 177.427 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' -3' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -134.52 123.73 24.39 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.083 1.353 . . . . 0.0 110.626 178.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 65.3 mtt -124.53 109.98 13.9 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.968 1.307 . . . . 0.0 110.447 178.645 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.26 -67.75 0.69 Allowed 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.955 1.302 . . . . 0.0 111.881 175.503 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 0' ' ' SER . . . . . . . . . . . . . 1.2 t 53.87 28.28 8.24 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 125.547 1.539 . . . . 0.0 114.901 178.445 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -152.64 -18.72 0.16 Allowed 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -179.708 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -112.4 13.53 20.26 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.671 1.588 . . . . 0.0 112.837 -179.502 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -147.8 33.16 0.84 Allowed 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 126.193 1.797 . . . . 0.0 111.335 -168.83 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 8.8 mp -117.39 168.08 10.68 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.263 1.825 . . . . 0.0 111.196 -179.811 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -129.56 2.7 5.02 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 125.169 1.388 . . . . 0.0 113.772 -175.433 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -89.26 12.42 16.08 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.408 1.483 . . . . 0.0 114.706 -175.64 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -73.05 132.56 33.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 C-N-CA 124.677 1.191 . . . . 0.0 111.276 -174.54 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 73.4 mt -132.92 138.47 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 126.028 1.731 . . . . 0.0 109.327 178.044 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -135.8 167.09 21.82 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.901 1.68 . . . . 0.0 111.734 179.074 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -131.6 175.4 9.2 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 125.081 1.352 . . . . 0.0 112.626 -179.347 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.9 tt -65.8 -26.21 38.19 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.764 0 C-N-CA 125.27 1.428 . . . . 0.0 114.697 -177.461 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.8 mm-40 53.89 42.27 31.77 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.305 1.442 . . . . 0.0 113.854 178.12 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.8 ttmt -92.38 -19.36 22.16 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 125.12 1.368 . . . . 0.0 112.548 176.155 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 58.05 40.25 25.53 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.212 1.805 . . . . 0.0 114.535 174.412 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.71 -62.16 2.0 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.354 1.462 . . . . 0.0 114.386 -172.423 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 50.1 mt -129.46 -11.78 2.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 C-N-CA 124.693 1.197 . . . . 0.0 113.602 -172.574 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -74.56 -15.17 60.86 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -173.274 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.3 t -81.45 -53.39 6.33 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.665 0.786 . . . . 0.0 112.492 178.147 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 12.5 p30 -68.1 -18.19 64.58 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -172.623 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 89.7 t -78.08 -22.91 13.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.152 1.381 . . . . 0.0 111.832 174.241 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 2.9 t -129.56 53.06 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.675 1.59 . . . . 0.0 110.933 -171.438 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 21.2 mt -132.07 152.17 51.35 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 125.588 1.555 . . . . 0.0 112.109 175.068 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -122.37 32.0 5.94 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 126.478 1.911 . . . . 0.0 112.573 -175.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 t30 48.97 59.18 17.45 Favored Pre-proline 0 CA--C 1.559 1.295 0 C-N-CA 126.924 2.09 . . . . 0.0 113.877 -174.476 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 67.1 Cg_endo -77.94 78.21 3.65 Favored 'Trans proline' 0 CA--C 1.544 0.984 0 C-N-CA 123.844 3.029 . . . . 0.0 112.551 -174.0 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -129.58 -59.5 1.08 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.159 1.384 . . . . 0.0 113.477 176.142 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 7.1 p -153.96 116.47 2.61 Favored Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 124.82 1.248 . . . . 0.0 110.946 -174.356 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -86.28 159.1 9.73 Favored 'Trans proline' 0 CA--C 1.534 0.478 0 C-N-CA 123.367 2.711 . . . . 0.0 112.709 176.0 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.4 p -82.9 58.78 4.51 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.93 1.692 . . . . 0.0 112.254 174.822 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 56.75 25.61 10.43 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.647 1.979 . . . . 0.0 114.911 178.347 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.35 34.93 0.26 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.442 1.897 . . . . 0.0 113.569 -172.58 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.5 t -137.0 8.19 2.97 Favored 'General case' 0 N--CA 1.48 1.064 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -162.886 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -164.28 36.88 0.3 Allowed Glycine 0 CA--C 1.535 1.305 0 O-C-N 120.857 -1.152 . . . . 0.0 114.339 -175.555 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -93.39 24.06 4.15 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 125.106 1.362 . . . . 0.0 114.281 -166.409 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 56.66 82.17 0.12 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 127.875 2.47 . . . . 0.0 114.172 169.099 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 35.5 t -76.96 -79.56 0.11 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.503 1.121 . . . . 0.0 112.886 -173.39 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.47 -44.06 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.579 0.752 . . . . 0.0 111.403 -170.754 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -72.57 -28.34 62.75 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.027 0.531 . . . . 0.0 111.08 171.797 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -72.36 -49.73 32.01 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.448 1.099 . . . . 0.0 112.043 -171.167 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.0 ptpt -65.37 -25.47 67.58 Favored 'General case' 0 N--CA 1.477 0.912 0 O-C-N 120.304 -1.497 . . . . 0.0 113.481 172.188 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -66.95 -5.54 13.12 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 114.763 1.394 . . . . 0.0 114.763 167.478 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.31 -52.68 8.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 C-N-CA 125.121 1.368 . . . . 0.0 110.043 167.153 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 27.8 t -79.41 -51.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 -171.039 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.41 -32.95 74.18 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 118.982 0.81 . . . . 0.0 110.948 179.065 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.03 -36.35 74.82 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 167.773 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -71.41 -40.67 70.34 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.123 -0.986 . . . . 0.0 111.776 175.72 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.2 -31.16 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 O-C-N 120.86 -1.15 . . . . 0.0 111.133 172.233 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 2.1 t -72.79 -17.23 61.6 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 114.2 1.185 . . . . 0.0 114.2 171.693 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -102.49 -42.72 5.86 Favored 'General case' 0 CA--C 1.54 0.575 0 O-C-N 120.725 -1.234 . . . . 0.0 112.641 -170.665 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -130.98 -12.86 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -171.871 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 128.21 -82.54 0.34 Allowed Glycine 0 N--CA 1.469 0.852 0 C-N-CA 125.389 1.471 . . . . 0.0 112.59 167.095 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 65.5 tp -167.64 -36.27 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.263 1.825 . . . . 0.0 111.666 -179.117 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 11.1 p30 -112.29 -10.14 13.83 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.189 1.396 . . . . 0.0 114.645 -167.475 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 62.3 m-80 -93.43 -15.31 25.75 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 124.158 0.983 . . . . 0.0 112.886 179.233 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 3.7 pp -71.78 164.92 25.11 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.23 1.412 . . . . 0.0 113.533 177.101 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -110.13 118.63 36.9 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.637 1.175 . . . . 0.0 111.626 -179.501 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -62.71 -23.7 67.28 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.639 1.176 . . . . 0.0 113.389 176.501 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.8 m -69.43 -41.38 76.4 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 121.313 -0.867 . . . . 0.0 111.543 173.543 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -61.3 -41.26 96.69 Favored 'General case' 0 N--CA 1.475 0.781 0 O-C-N 120.796 -1.19 . . . . 0.0 111.736 172.71 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.2 mp -56.87 -46.32 81.89 Favored 'General case' 0 N--CA 1.473 0.687 0 O-C-N 121.675 -0.64 . . . . 0.0 111.795 168.787 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.1 p -60.59 -22.41 63.68 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 120.516 -1.365 . . . . 0.0 113.887 178.821 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -94.66 -43.04 8.46 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.114 1.766 . . . . 0.0 112.064 -175.492 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 26.4 mmt85 -79.22 -37.61 37.69 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.249 1.419 . . . . 0.0 112.835 176.872 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 3.0 tp -98.88 -12.02 21.15 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.956 1.702 . . . . 0.0 113.544 -173.064 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.76 55.62 4.57 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 125.116 1.367 . . . . 0.0 112.643 176.218 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 10.1 pt -123.23 163.98 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 126.971 2.108 . . . . 0.0 110.731 174.913 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 58.8 m -57.88 139.44 54.2 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.711 1.204 . . . . 0.0 110.394 163.149 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.2 t -61.22 -33.82 57.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.226 0 O-C-N 121.116 -0.99 . . . . 0.0 111.642 -179.547 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -72.76 -31.98 65.29 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.34 -0.85 . . . . 0.0 112.946 176.281 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -63.27 -39.56 94.92 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 118.109 -0.948 . . . . 0.0 110.683 167.121 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.18 -49.78 72.91 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.147 0.885 . . . . 0.0 110.896 178.745 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.51 -33.95 73.38 Favored 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.032 1.123 . . . . 0.0 114.032 -179.737 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 5.8 t -86.12 -40.52 15.6 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-N 119.348 0.976 . . . . 0.0 112.825 175.689 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -58.45 -37.39 75.33 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 124.974 1.31 . . . . 0.0 113.056 -179.362 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 41.3 mt -49.05 -39.8 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 124.953 1.301 . . . . 0.0 111.708 171.785 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -90.25 -32.5 16.53 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.718 1.207 . . . . 0.0 113.531 178.333 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -66.19 -34.53 78.24 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-N 118.688 0.676 . . . . 0.0 111.842 -176.633 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 16.8 m -82.44 -39.39 22.64 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 176.487 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -156.42 79.15 0.95 Allowed 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -171.724 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 32.5 ptt-85 -97.94 10.78 39.44 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 125.895 1.678 . . . . 0.0 115.016 170.506 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 85.3 mtp -64.04 -27.33 69.04 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -157.85 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 172.46 -69.01 0.11 Allowed Glycine 0 N--CA 1.469 0.859 0 CA-C-N 119.358 0.981 . . . . 0.0 111.436 161.608 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 70.9 mtp85 -113.17 -91.86 0.49 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 125.564 1.546 . . . . 0.0 109.173 166.868 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 62.4 p -139.92 37.2 1.96 Allowed 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.346 1.058 . . . . 0.0 113.461 -173.811 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 61.29 19.36 10.07 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 125.836 1.654 . . . . 0.0 113.451 -176.045 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -82.08 -13.22 57.61 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 126.583 1.953 . . . . 0.0 113.974 -178.483 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 48.6 p90 -74.17 14.71 0.39 Allowed 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 126.642 1.977 . . . . 0.0 114.83 -172.097 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -80.24 -19.12 47.6 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 125.397 1.479 . . . . 0.0 112.974 -170.79 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 88.3 m -122.72 -39.07 2.56 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 126.599 1.96 . . . . 0.0 111.477 -172.834 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 33.4 mt -67.27 158.82 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 124.559 1.144 . . . . 0.0 108.415 165.131 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.6 ttmm 67.51 -10.58 0.35 Allowed 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 167.644 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' MET . . . . . . . . . . . . . 24.3 ptt? -83.6 -26.37 30.06 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 119.113 0.869 . . . . 0.0 113.162 175.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.1 p90 -121.57 -10.83 8.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.844 1.258 . . . . 0.0 114.359 -175.172 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -85.04 133.52 34.24 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.64 1.176 . . . . 0.0 111.788 -176.871 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -151.48 110.58 3.9 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.079 1.351 . . . . 0.0 110.627 177.36 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 55.6 176.28 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 126.515 1.926 . . . . 0.0 114.798 -168.399 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 96.7 t -99.43 -19.19 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 125.001 1.32 . . . . 0.0 111.471 178.659 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 34.9 m 57.65 22.69 8.56 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.768 1.627 . . . . 0.0 113.716 -168.14 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 19.1 t -154.77 144.01 21.16 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.96 1.704 . . . . 0.0 110.482 173.47 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -154.65 166.43 33.4 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.452 1.501 . . . . 0.0 111.7 -176.001 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 8.4 t -106.68 178.52 4.54 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.86 1.264 . . . . 0.0 111.196 175.136 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -61.54 -31.87 71.91 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 174.396 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -148.61 150.74 34.34 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 126.696 1.998 . . . . 0.0 111.717 174.012 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -75.63 92.52 1.02 Allowed 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 123.658 2.906 . . . . 0.0 112.313 -176.044 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 70.3 m-20 54.39 37.63 27.99 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.511 1.924 . . . . 0.0 113.445 177.597 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 3.6 tt -126.14 97.27 35.16 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 125.405 1.482 . . . . 0.0 109.717 -171.159 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_endo . . . . . 0 C--O 1.253 1.252 0 C-N-CA 124.055 3.17 . . . . 0.0 113.455 -175.723 . . . . . . . . 0 0 . 1 stop_ save_